2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide

C13H14N6O2 — CID 137001767

IUPAC2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccn2c(C(=O)NCc3n[nH]c(=O)[nH]3)c(C)nc2c1
InChIInChI=1S/C13H14N6O2/c1-7-3-4-19-10(5-7)15-8(2)11(19)12(20)14-6-9-16-13(21)18-17-9/h3-5H,6H2,1-2H3,(H,14,20)(H2,16,17,18,21)
InChIKeyYUHSAXGSNNTMKN-UHFFFAOYSA-N
MW286.30 g/mol
LogP0.29
Rot. Bonds3

About 2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide

2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 137001767) has the molecular formula C13H14N6O2 and a molecular weight of 286.30 g/mol. Its IUPAC name is 2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID137001767
Molecular FormulaC13H14N6O2
Molecular Weight286.30 g/mol
Exact Mass286.12
IUPAC Name2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccn2c(C(=O)NCc3n[nH]c(=O)[nH]3)c(C)nc2c1
InChIInChI=1S/C13H14N6O2/c1-7-3-4-19-10(5-7)15-8(2)11(19)12(20)14-6-9-16-13(21)18-17-9/h3-5H,6H2,1-2H3,(H,14,20)(H2,16,17,18,21)
InChIKeyYUHSAXGSNNTMKN-UHFFFAOYSA-N
XLogP0.29
TPSA107.94 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.30
LogP ≤ 50.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-chlorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 53248894
2,7-dimethyl-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 121274552
N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide
CID 2814534
2,7-dimethyl-N-(2-phenoxyethyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 134140165
7-ethyl-2-methyl-N-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 171356527
2-[(2,7-dimethylimidazo[1,2-a]pyridine-3-carbonyl)amino]-2-methylpropanoic acid
CID 39186456
N-[3-(furan-2-yl)propyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 56759259
N-[(3-fluoro-2,3-dihydro-1-benzofuran-5-yl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 126710537
N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 119062037
8-methyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 137205295
2-[(2,7-dimethylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-methylpentanoic acid
CID 82032865
2,7-dimethyl-N-[2-(3-nitrophenoxy)ethyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 134154995

Frequently Asked Questions

What is the IUPAC name of 2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide (CID 137001767) is 2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide is Cc1ccn2c(C(=O)NCc3n[nH]c(=O)[nH]3)c(C)nc2c1.
What is the InChIKey of 2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is YUHSAXGSNNTMKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N6O2/c1-7-3-4-19-10(5-7)15-8(2)11(19)12(20)14-6-9-16-13(21)18-17-9/h3-5H,6H2,1-2H3,(H,14,20)(H2,16,17,18,21).
What are the key properties of 2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide?
2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 286.30 g/mol, XLogP of 0.29, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 137001767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).