3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide

C23H22N4O — CID 46277287

IUPAC3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide
SMILESCc1ccc(C(=O)NCCCc2ccccc2)cc1-n1cnc2cccnc21
InChIInChI=1S/C23H22N4O/c1-17-11-12-19(23(28)25-14-5-9-18-7-3-2-4-8-18)15-21(17)27-16-26-20-10-6-13-24-22(20)27/h2-4,6-8,10-13,15-16H,5,9,14H2,1H3,(H,25,28)
InChIKeyFJFNHBIBXYEMOI-UHFFFAOYSA-N
MW370.46 g/mol
LogP4.09
Rot. Bonds6

About 3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide

3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide (PubChem CID 46277287) has the molecular formula C23H22N4O and a molecular weight of 370.46 g/mol. Its IUPAC name is 3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide.

Molecular Properties

Compound Name3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide
PubChem CID46277287
Molecular FormulaC23H22N4O
Molecular Weight370.46 g/mol
Exact Mass370.18
IUPAC Name3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide
SMILESCc1ccc(C(=O)NCCCc2ccccc2)cc1-n1cnc2cccnc21
InChIInChI=1S/C23H22N4O/c1-17-11-12-19(23(28)25-14-5-9-18-7-3-2-4-8-18)15-21(17)27-16-26-20-10-6-13-24-22(20)27/h2-4,6-8,10-13,15-16H,5,9,14H2,1H3,(H,25,28)
InChIKeyFJFNHBIBXYEMOI-UHFFFAOYSA-N
XLogP4.09
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.46
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-chloro-3-imidazo[4,5-b]pyridin-3-yl-N-(2-phenylethyl)benzamide
CID 46277393
4-methyl-N-(4-phenylbutyl)-3-pyrrol-1-ylbenzamide
CID 18273813
4-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-imidazo[4,5-b]pyridin-3-ylbenzamide
CID 46277387
4-imidazo[4,5-b]pyridin-3-yl-3-methylbenzoic acid
CID 82513914
4-[3-(2,5-dimethylpyrrol-1-yl)-2-pyridinyl]-N-(3-phenylpropyl)benzamide
CID 20973854
1-methyl-2-oxo-N-(3-phenylpropyl)-1,8-naphthyridine-3-carboxamide
CID 7619447
N-cyclopropyl-4-methyl-3-[2-oxo-3-(3-phenylpropylamino)pyrazin-1-yl]benzamide
CID 66689834
3-(diethylsulfamoyl)-4-methyl-N-(3-phenylpropyl)benzamide
CID 27647029
N-(2-methoxyethyl)-4-methyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide
CID 46277332
4-N-tert-butyl-1-N-(3-phenylpropyl)benzene-1,4-dicarboxamide
CID 48846619
4-methyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
CID 20916291
2-(diethylamino)-N-(3-phenylpropyl)pyridine-4-carboxamide
CID 109174754

Frequently Asked Questions

What is the IUPAC name of 3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide?
The IUPAC name of 3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide (CID 46277287) is 3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide.
What is the SMILES notation for 3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide?
The canonical SMILES for 3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide is Cc1ccc(C(=O)NCCCc2ccccc2)cc1-n1cnc2cccnc21.
What is the InChIKey of 3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide?
The InChIKey is FJFNHBIBXYEMOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O/c1-17-11-12-19(23(28)25-14-5-9-18-7-3-2-4-8-18)15-21(17)27-16-26-20-10-6-13-24-22(20)27/h2-4,6-8,10-13,15-16H,5,9,14H2,1H3,(H,25,28).
What are the key properties of 3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide?
3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide has a molecular weight of 370.46 g/mol, XLogP of 4.09, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazo[4,5-b]pyridin-3-yl-4-methyl-N-(3-phenylpropyl)benzamide is sourced from PubChem (CID 46277287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).