N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide

C13H17N3O — CID 34674868

IUPACN-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCC[C@H](C)NC(=O)c1cn2ccc(C)cc2n1
InChIInChI=1S/C13H17N3O/c1-4-10(3)14-13(17)11-8-16-6-5-9(2)7-12(16)15-11/h5-8,10H,4H2,1-3H3,(H,14,17)/t10-/m0/s1
InChIKeyAZPDCLSQAYOSMM-JTQLQIEISA-N
MW231.30 g/mol
LogP2.17
Rot. Bonds3

About N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide

N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 34674868) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID34674868
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC NameN-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCC[C@H](C)NC(=O)c1cn2ccc(C)cc2n1
InChIInChI=1S/C13H17N3O/c1-4-10(3)14-13(17)11-8-16-6-5-9(2)7-12(16)15-11/h5-8,10H,4H2,1-3H3,(H,14,17)/t10-/m0/s1
InChIKeyAZPDCLSQAYOSMM-JTQLQIEISA-N
XLogP2.17
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid
CID 119194403
7-methyl-N-[1-oxo-1-(propylamino)propan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide
CID 46655437
N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 175305720
N-(2-acetamidoethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 46684175
N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 51108649
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
7-methyl-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 35242555
N-benzyl-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 1172225
N-[(2S)-heptan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide
CID 51969987
propan-2-yl 3-(4-methoxyphenyl)-3-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate
CID 42920387
7-methyl-N-(4-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 51250537

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide (CID 34674868) is N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide is CC[C@H](C)NC(=O)c1cn2ccc(C)cc2n1.
What is the InChIKey of N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is AZPDCLSQAYOSMM-JTQLQIEISA-N. The full InChI is InChI=1S/C13H17N3O/c1-4-10(3)14-13(17)11-8-16-6-5-9(2)7-12(16)15-11/h5-8,10H,4H2,1-3H3,(H,14,17)/t10-/m0/s1.
What are the key properties of N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide?
N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 231.30 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 34674868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).