Chemical identity

2-Amino-3-(2-oxo-1,2-dihydroquinolin-4-yl)propanoic Acid

CAS 5162-90-3 · C12H12N2O3

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-01769
PubChem CID10243015
Name2-Amino-3-(2-oxo-1,2-dihydroquinolin-4-yl)propanoic Acid
CAS RN5162-90-3
Molecular formulaC12H12N2O3
Molecular weight232.24 g/mol
IUPAC name2-Amino-3-(2-oxo-1,2-dihydroquinolin-4-yl)propanoic Acid
InChIKeyNOILRCJONSGSRP-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 10243015
2D structure: 2-Amino-3-(2-oxo-1,2-dihydroquinolin-4-yl)propanoic Acid, CAS 5162-90-3
Structure of 2-Amino-3-(2-oxo-1,2-dihydroquinolin-4-yl)propanoic Acid (CAS 5162-90-3). LazyChem record. Source identity: PubChem CID 10243015. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC12H12N2O3
InChIKeyNOILRCJONSGSRP-UHFFFAOYSA-N
Ring count2
Defined stereocentres0
Unassigned stereocentres1
SMILESO=C(O)C(N)CC1=CC(NC2=C1C=CC=C2)=O
InChIInChI=1S/C12H12N2O3/c13-9(12(16)17)5-7-6-11(15)14-10-4-2-1-3-8(7)10/h1-4,6,9H,5,13H2,(H,14,15)(H,16,17)

03Stereochemistry

The published structure contains 0 defined and 1 unassigned tetrahedral stereocentre. The exact wedge-and-dash depiction is shown above.

Defined stereocentres02D structure
Unassigned stereocentres12D structure
Assignment statusUnassignedExact published identity
Tetrahedral upper bound≤ 2Before symmetry reduction

Published same-connectivity configurations

2 records

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNOT FOUND IN REVIEWED ENTRIESCAS 5162-90-3 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 5162-90-3 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

05Names and relationships

Associated parent compound

Nalidixic acid

View API and impurity family

Other names

No synonyms are listed.

Related records from the same parent family

06Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

07Sources