N-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide

C21H18N4O — CID 20916242

IUPACN-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide
SMILESCc1nc2cccnc2n1-c1cccc(C(=O)NCc2ccccc2)c1
InChIInChI=1S/C21H18N4O/c1-15-24-19-11-6-12-22-20(19)25(15)18-10-5-9-17(13-18)21(26)23-14-16-7-3-2-4-8-16/h2-13H,14H2,1H3,(H,23,26)
InChIKeyDQHVFHKFZDLUCQ-UHFFFAOYSA-N
MW342.40 g/mol
LogP3.66
Rot. Bonds4

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

N-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide (PubChem CID 20916242) has the molecular formula C21H18N4O and a molecular weight of 342.40 g/mol. Its IUPAC name is N-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide.

Molecular Properties

Compound NameN-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide
PubChem CID20916242
Molecular FormulaC21H18N4O
Molecular Weight342.40 g/mol
Exact Mass342.15
IUPAC NameN-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide
SMILESCc1nc2cccnc2n1-c1cccc(C(=O)NCc2ccccc2)c1
InChIInChI=1S/C21H18N4O/c1-15-24-19-11-6-12-22-20(19)25(15)18-10-5-9-17(13-18)21(26)23-14-16-7-3-2-4-8-16/h2-13H,14H2,1H3,(H,23,26)
InChIKeyDQHVFHKFZDLUCQ-UHFFFAOYSA-N
XLogP3.66
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-[(4-methylphenyl)methyl]benzamide
CID 20916253
N-[(3-fluorophenyl)methyl]-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide
CID 20916290
3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(thiophen-2-ylmethyl)benzamide
CID 20916275
3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 46277271
3-(3-methylimidazo[4,5-b]pyridin-2-yl)-N-[(3-methylphenyl)methyl]benzamide
CID 53148817
3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[(3-methylphenyl)methyl]propanamide
CID 46277233
N-benzyl-3-pyrazol-1-ylbenzamide
CID 110698131
4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide
CID 20916096
N-benzyl-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
CID 6622635
2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propylacetamide
CID 20916146
1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[3-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methanone
CID 20916271
N-(2-methoxyethyl)-4-methyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide
CID 46277332

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide?
The IUPAC name of N-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide (CID 20916242) is N-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide.
What is the SMILES notation for N-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide?
The canonical SMILES for N-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide is Cc1nc2cccnc2n1-c1cccc(C(=O)NCc2ccccc2)c1.
What is the InChIKey of N-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide?
The InChIKey is DQHVFHKFZDLUCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O/c1-15-24-19-11-6-12-22-20(19)25(15)18-10-5-9-17(13-18)21(26)23-14-16-7-3-2-4-8-16/h2-13H,14H2,1H3,(H,23,26).
What are the key properties of N-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide?
N-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide has a molecular weight of 342.40 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide is sourced from PubChem (CID 20916242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).