3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide

C23H28N4O — CID 122445531

IUPAC3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide
SMILESO=C(CCc1nc2cccnc2n1Cc1ccccc1)NCC1CCCCC1
InChIInChI=1S/C23H28N4O/c28-22(25-16-18-8-3-1-4-9-18)14-13-21-26-20-12-7-15-24-23(20)27(21)17-19-10-5-2-6-11-19/h2,5-7,10-12,15,18H,1,3-4,8-9,13-14,16-17H2,(H,25,28)
InChIKeyMTKCUQVKZFPANE-UHFFFAOYSA-N
MW376.50 g/mol
LogP4.11
Rot. Bonds7

About 3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide

3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide (PubChem CID 122445531) has the molecular formula C23H28N4O and a molecular weight of 376.50 g/mol. Its IUPAC name is 3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide.

Molecular Properties

Compound Name3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide
PubChem CID122445531
Molecular FormulaC23H28N4O
Molecular Weight376.50 g/mol
Exact Mass376.23
IUPAC Name3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide
SMILESO=C(CCc1nc2cccnc2n1Cc1ccccc1)NCC1CCCCC1
InChIInChI=1S/C23H28N4O/c28-22(25-16-18-8-3-1-4-9-18)14-13-21-26-20-12-7-15-24-23(20)27(21)17-19-10-5-2-6-11-19/h2,5-7,10-12,15,18H,1,3-4,8-9,13-14,16-17H2,(H,25,28)
InChIKeyMTKCUQVKZFPANE-UHFFFAOYSA-N
XLogP4.11
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Zolpidem
CID 5732
2-Amino-1-Methyl-6-Phenylimidazo(4,5-b)Pyridine
CID 1530
Olprinone
CID 4593
2-(Hydroxyamino)-1-methyl-6-phenylimidazo(4,5-b)pyridine
CID 104954
N-(3-(1H-imidazol-1-yl)propyl)-5,7-diphenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 3113005
Zipalertinib
CID 117918742
2-Amino-1-(2-(4-fluorophenyl)-3-((4-fluorophenyl)amino)-5,6-dihydro-8,8-dimethylimidazo(1,2-a)pyrazin-7(8H)-yl)ethanone
CID 49856296
Diphenyl purine derivative 5
CID 72713196
(3R)-1-(2-(1-((4-fluorophenyl)methyl)-1H-indol-2-yl)-3-methylimidazo(1,2-a)pyridine-7-carbonyl)piperidin-3-amine
CID 138578805
3-[(3r)-3-(Imidazo[4,5-D]pyrrolo[2,3-B]pyridin-1(6h)-Yl)piperidin-1-Yl]-3-Oxopropanenitrile
CID 53341457
N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
CID 748028
1-Benzyl-1H-1,3,4b,9-tetraaza-fluorene-2,4-dione
CID 21604934

Frequently Asked Questions

What is the IUPAC name of 3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide?
The IUPAC name of 3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide (CID 122445531) is 3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide.
What is the SMILES notation for 3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide?
The canonical SMILES for 3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide is O=C(CCc1nc2cccnc2n1Cc1ccccc1)NCC1CCCCC1.
What is the InChIKey of 3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide?
The InChIKey is MTKCUQVKZFPANE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O/c28-22(25-16-18-8-3-1-4-9-18)14-13-21-26-20-12-7-15-24-23(20)27(21)17-19-10-5-2-6-11-19/h2,5-7,10-12,15,18H,1,3-4,8-9,13-14,16-17H2,(H,25,28).
What are the key properties of 3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide?
3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide has a molecular weight of 376.50 g/mol, XLogP of 4.11, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-benzylimidazo[4,5-b]pyridin-2-yl)-N-(cyclohexylmethyl)propanamide is sourced from PubChem (CID 122445531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).