N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide

C24H24N4O — CID 50806674

IUPACN-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide
SMILESCc1ccc(CNC(=O)CCCc2nc3cccnc3n2-c2ccccc2)cc1
InChIInChI=1S/C24H24N4O/c1-18-12-14-19(15-13-18)17-26-23(29)11-5-10-22-27-21-9-6-16-25-24(21)28(22)20-7-3-2-4-8-20/h2-4,6-9,12-16H,5,10-11,17H2,1H3,(H,26,29)
InChIKeyKFWNOQUFQAWVKZ-UHFFFAOYSA-N
MW384.48 g/mol
LogP4.37
Rot. Bonds7

About N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide

N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide (PubChem CID 50806674) has the molecular formula C24H24N4O and a molecular weight of 384.48 g/mol. Its IUPAC name is N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide.

Molecular Properties

Compound NameN-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide
PubChem CID50806674
Molecular FormulaC24H24N4O
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC NameN-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide
SMILESCc1ccc(CNC(=O)CCCc2nc3cccnc3n2-c2ccccc2)cc1
InChIInChI=1S/C24H24N4O/c1-18-12-14-19(15-13-18)17-26-23(29)11-5-10-22-27-21-9-6-16-25-24(21)28(22)20-7-3-2-4-8-20/h2-4,6-9,12-16H,5,10-11,17H2,1H3,(H,26,29)
InChIKeyKFWNOQUFQAWVKZ-UHFFFAOYSA-N
XLogP4.37
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
CID 6622635
2-[(4-methylphenyl)methyl]-3-phenylimidazo[4,5-b]pyridine
CID 117165506
N-(3-methylbutyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
CID 20867503
N-[2-(4-chlorophenyl)ethyl]-4-[3-[(4-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]butanamide
CID 46360101
3-(3-ethyl-4-oxoquinazolin-2-yl)-N-[(4-methylphenyl)methyl]propanamide
CID 53159170
3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[(3-methylphenyl)methyl]propanamide
CID 46277233
4-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(3,5-dimethylphenyl)butanamide
CID 46360070
N-(4-acetylphenyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
CID 126458385
3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-[(4-methylphenyl)methyl]benzamide
CID 20916253
N-[(4-fluorophenyl)methyl]-4-[(3-phenylimidazo[4,5-b]pyridin-2-yl)methyl]piperazine-1-carboxamide
CID 50830755
N-cyclohexyl-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
CID 20867515
3-[3-(3-methylphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159732

Frequently Asked Questions

What is the IUPAC name of N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide?
The IUPAC name of N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide (CID 50806674) is N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide.
What is the SMILES notation for N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide?
The canonical SMILES for N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide is Cc1ccc(CNC(=O)CCCc2nc3cccnc3n2-c2ccccc2)cc1.
What is the InChIKey of N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide?
The InChIKey is KFWNOQUFQAWVKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O/c1-18-12-14-19(15-13-18)17-26-23(29)11-5-10-22-27-21-9-6-16-25-24(21)28(22)20-7-3-2-4-8-20/h2-4,6-9,12-16H,5,10-11,17H2,1H3,(H,26,29).
What are the key properties of N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide?
N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide has a molecular weight of 384.48 g/mol, XLogP of 4.37, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide is sourced from PubChem (CID 50806674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).