(2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid

C15H19N3O3 — CID 119194403

IUPAC(2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid
SMILESCC[C@H](C)[C@H](NC(=O)c1cn2ccc(C)cc2n1)C(=O)O
InChIInChI=1S/C15H19N3O3/c1-4-10(3)13(15(20)21)17-14(19)11-8-18-6-5-9(2)7-12(18)16-11/h5-8,10,13H,4H2,1-3H3,(H,17,19)(H,20,21)/t10-,13-/m0/s1
InChIKeyLRFXLBBBJVQNTF-GWCFXTLKSA-N
MW289.34 g/mol
LogP1.87
Rot. Bonds5

About (2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid

(2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid (PubChem CID 119194403) has the molecular formula C15H19N3O3 and a molecular weight of 289.34 g/mol. Its IUPAC name is (2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid.

Molecular Properties

Compound Name(2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid
PubChem CID119194403
Molecular FormulaC15H19N3O3
Molecular Weight289.34 g/mol
Exact Mass289.14
IUPAC Name(2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid
SMILESCC[C@H](C)[C@H](NC(=O)c1cn2ccc(C)cc2n1)C(=O)O
InChIInChI=1S/C15H19N3O3/c1-4-10(3)13(15(20)21)17-14(19)11-8-18-6-5-9(2)7-12(18)16-11/h5-8,10,13H,4H2,1-3H3,(H,17,19)(H,20,21)/t10-,13-/m0/s1
InChIKeyLRFXLBBBJVQNTF-GWCFXTLKSA-N
XLogP1.87
TPSA83.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid with MolForge

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Related Compounds

N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 34674868
(2S)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)-3-methylpentanoic acid
CID 61173973
N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 175305720
7-methyl-N-[1-oxo-1-(propylamino)propan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide
CID 46655437
2-[(2,7-dimethylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-methylpentanoic acid
CID 82032865
7-methyl-N-[1-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 51201031
3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]-3-thiophen-2-ylpropanoic acid
CID 71942406
N-(2-acetamidoethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 46684175
7-methyl-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 35242555
N-[(R)-cyclopropyl-(4-methoxyphenyl)methyl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 25388515
N-(5-chloro-2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 17394074
N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 94169651

Frequently Asked Questions

What is the IUPAC name of (2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid?
The IUPAC name of (2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid (CID 119194403) is (2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid.
What is the SMILES notation for (2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid?
The canonical SMILES for (2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid is CC[C@H](C)[C@H](NC(=O)c1cn2ccc(C)cc2n1)C(=O)O.
What is the InChIKey of (2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid?
The InChIKey is LRFXLBBBJVQNTF-GWCFXTLKSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-4-10(3)13(15(20)21)17-14(19)11-8-18-6-5-9(2)7-12(18)16-11/h5-8,10,13H,4H2,1-3H3,(H,17,19)(H,20,21)/t10-,13-/m0/s1.
What are the key properties of (2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid?
(2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid has a molecular weight of 289.34 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid is sourced from PubChem (CID 119194403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).