3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide

C17H15N7O — CID 166581398

IUPAC3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide
SMILESO=C(CCc1cn2ccccc2n1)Nc1n[nH]c(-c2ccncc2)n1
InChIInChI=1S/C17H15N7O/c25-15(5-4-13-11-24-10-2-1-3-14(24)19-13)20-17-21-16(22-23-17)12-6-8-18-9-7-12/h1-3,6-11H,4-5H2,(H2,20,21,22,23,25)
InChIKeyXTNOTSHGBQKWRA-UHFFFAOYSA-N
MW333.36 g/mol
LogP2.09
Rot. Bonds5

About 3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide

3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide (PubChem CID 166581398) has the molecular formula C17H15N7O and a molecular weight of 333.36 g/mol. Its IUPAC name is 3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide.

Molecular Properties

Compound Name3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide
PubChem CID166581398
Molecular FormulaC17H15N7O
Molecular Weight333.36 g/mol
Exact Mass333.13
IUPAC Name3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide
SMILESO=C(CCc1cn2ccccc2n1)Nc1n[nH]c(-c2ccncc2)n1
InChIInChI=1S/C17H15N7O/c25-15(5-4-13-11-24-10-2-1-3-14(24)19-13)20-17-21-16(22-23-17)12-6-8-18-9-7-12/h1-3,6-11H,4-5H2,(H2,20,21,22,23,25)
InChIKeyXTNOTSHGBQKWRA-UHFFFAOYSA-N
XLogP2.09
TPSA100.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.36
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-(2,4-dimethylphenyl)-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide
CID 166581420
N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)-2,3-dihydro-1H-indene-2-carboxamide
CID 166581405
1-cyclopropyl-3-imidazo[1,2-a]pyridin-2-ylpropan-1-one
CID 79417170
2-(3-chloro-4-fluorophenyl)-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)acetamide
CID 11537271
3-imidazo[1,2-a]pyridin-2-yl-N-(1-imidazol-1-yl-3,3-dimethylbutan-2-yl)propanamide
CID 74247075
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide
CID 91831552
N-[(5-ethyl-1,3,4-thiadiazol-2-yl)methyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide
CID 50979857
3-imidazo[1,2-a]pyridin-2-yl-N-[(1S)-1-imidazo[2,1-b][1,3,4]thiadiazol-6-ylethyl]propanamide
CID 95123356
N-[2-(2-chlorophenoxy)ethyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide
CID 74243702
6-pyrrol-1-yl-N-(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)hexanamide
CID 127255326
N-[2-(hydroxymethyl)-3-thiophen-2-ylpropyl]-3-imidazo[1,2-a]pyridin-2-ylpropanamide
CID 74230031
2-imidazo[1,2-a]pyridin-2-ylethanamine
CID 7536516

Frequently Asked Questions

What is the IUPAC name of 3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide?
The IUPAC name of 3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide (CID 166581398) is 3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide.
What is the SMILES notation for 3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide?
The canonical SMILES for 3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide is O=C(CCc1cn2ccccc2n1)Nc1n[nH]c(-c2ccncc2)n1.
What is the InChIKey of 3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide?
The InChIKey is XTNOTSHGBQKWRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N7O/c25-15(5-4-13-11-24-10-2-1-3-14(24)19-13)20-17-21-16(22-23-17)12-6-8-18-9-7-12/h1-3,6-11H,4-5H2,(H2,20,21,22,23,25).
What are the key properties of 3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide?
3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide has a molecular weight of 333.36 g/mol, XLogP of 2.09, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazo[1,2-a]pyridin-2-yl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide is sourced from PubChem (CID 166581398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).