4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide

C25H19N5O — CID 20916096

IUPAC4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide
SMILESO=C(NCc1cccnc1)c1ccc(-n2c(-c3ccccc3)nc3cccnc32)cc1
InChIInChI=1S/C25H19N5O/c31-25(28-17-18-6-4-14-26-16-18)20-10-12-21(13-11-20)30-23(19-7-2-1-3-8-19)29-22-9-5-15-27-24(22)30/h1-16H,17H2,(H,28,31)
InChIKeyCKOBDDXGGGXAGI-UHFFFAOYSA-N
MW405.46 g/mol
LogP4.41
Rot. Bonds5

About 4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide

4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide (PubChem CID 20916096) has the molecular formula C25H19N5O and a molecular weight of 405.46 g/mol. Its IUPAC name is 4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide
PubChem CID20916096
Molecular FormulaC25H19N5O
Molecular Weight405.46 g/mol
Exact Mass405.16
IUPAC Name4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide
SMILESO=C(NCc1cccnc1)c1ccc(-n2c(-c3ccccc3)nc3cccnc32)cc1
InChIInChI=1S/C25H19N5O/c31-25(28-17-18-6-4-14-26-16-18)20-10-12-21(13-11-20)30-23(19-7-2-1-3-8-19)29-22-9-5-15-27-24(22)30/h1-16H,17H2,(H,28,31)
InChIKeyCKOBDDXGGGXAGI-UHFFFAOYSA-N
XLogP4.41
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.46
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(dimethylamino)ethyl]-4-(2-phenylimidazo[4,5-b]pyridin-3-yl)benzamide
CID 20916098
N-(2-morpholin-4-ylethyl)-4-(2-phenylimidazo[4,5-b]pyridin-3-yl)benzamide
CID 20916111
4-[(2-benzylsulfanylimidazo[4,5-b]pyridin-3-yl)methyl]-N-(pyridin-3-ylmethyl)benzamide
CID 20908363
4-(2-pyridin-3-ylimidazo[4,5-b]pyridin-3-yl)phenol
CID 117164759
N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-4-(2-phenylimidazo[4,5-b]pyridin-3-yl)benzamide
CID 92706241
[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-piperidin-1-ylmethanone
CID 20916124
2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide
CID 20916212
5-chloro-2-phenyl-N-(pyridin-3-ylmethyl)pyrimidine-4-carboxamide
CID 166322102
N-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide
CID 20916242
4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide
CID 20916068
4-[4-methyl-7-oxo-2-(4-phenylpiperazin-1-yl)pyrido[2,3-d]pyrimidin-8-yl]-N-(pyridin-3-ylmethyl)benzamide
CID 10459691
4-(3,5-dimethylpyrazol-1-yl)-N-(pyridin-3-ylmethyl)benzamide
CID 26251280

Frequently Asked Questions

What is the IUPAC name of 4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide?
The IUPAC name of 4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide (CID 20916096) is 4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide.
What is the SMILES notation for 4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide?
The canonical SMILES for 4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide is O=C(NCc1cccnc1)c1ccc(-n2c(-c3ccccc3)nc3cccnc32)cc1.
What is the InChIKey of 4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide?
The InChIKey is CKOBDDXGGGXAGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19N5O/c31-25(28-17-18-6-4-14-26-16-18)20-10-12-21(13-11-20)30-23(19-7-2-1-3-8-19)29-22-9-5-15-27-24(22)30/h1-16H,17H2,(H,28,31).
What are the key properties of 4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide?
4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide has a molecular weight of 405.46 g/mol, XLogP of 4.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide is sourced from PubChem (CID 20916096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).