3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid

C16H15N3O3S — CID 71942406

IUPAC3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid
SMILESCc1ccn2cc(C(=O)NC(CC(=O)O)c3cccs3)nc2c1
InChIInChI=1S/C16H15N3O3S/c1-10-4-5-19-9-12(17-14(19)7-10)16(22)18-11(8-15(20)21)13-3-2-6-23-13/h2-7,9,11H,8H2,1H3,(H,18,22)(H,20,21)
InChIKeyCSQDLKCIHHXBEF-UHFFFAOYSA-N
MW329.38 g/mol
LogP2.65
Rot. Bonds5

About 3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid

3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid (PubChem CID 71942406) has the molecular formula C16H15N3O3S and a molecular weight of 329.38 g/mol. Its IUPAC name is 3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid.

Molecular Properties

Compound Name3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid
PubChem CID71942406
Molecular FormulaC16H15N3O3S
Molecular Weight329.38 g/mol
Exact Mass329.08
IUPAC Name3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid
SMILESCc1ccn2cc(C(=O)NC(CC(=O)O)c3cccs3)nc2c1
InChIInChI=1S/C16H15N3O3S/c1-10-4-5-19-9-12(17-14(19)7-10)16(22)18-11(8-15(20)21)13-3-2-6-23-13/h2-7,9,11H,8H2,1H3,(H,18,22)(H,20,21)
InChIKeyCSQDLKCIHHXBEF-UHFFFAOYSA-N
XLogP2.65
TPSA83.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3R)-3-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid
CID 95572538
(2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid
CID 119194403
N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 55383976
N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 175305720
7-methyl-N-(2-thiophen-2-ylphenyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 71900639
N-benzyl-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 1172225
7-methyl-N-[1-oxo-1-(propylamino)propan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide
CID 46655437
propan-2-yl 3-(4-methoxyphenyl)-3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate
CID 42920387
N-(2-acetamidoethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 46684175
3-[(2-amino-4-methyl-1,3-thiazole-5-carbonyl)amino]-3-thiophen-2-ylpropanoic acid
CID 62794621
N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 51108649
N-(3-chlorophenyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 40723677

Frequently Asked Questions

What is the IUPAC name of 3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid?
The IUPAC name of 3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid (CID 71942406) is 3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid.
What is the SMILES notation for 3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid?
The canonical SMILES for 3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid is Cc1ccn2cc(C(=O)NC(CC(=O)O)c3cccs3)nc2c1.
What is the InChIKey of 3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid?
The InChIKey is CSQDLKCIHHXBEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3S/c1-10-4-5-19-9-12(17-14(19)7-10)16(22)18-11(8-15(20)21)13-3-2-6-23-13/h2-7,9,11H,8H2,1H3,(H,18,22)(H,20,21).
What are the key properties of 3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid?
3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid has a molecular weight of 329.38 g/mol, XLogP of 2.65, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid is sourced from PubChem (CID 71942406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).