N-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide

C23H28N4O — CID 20916237

IUPACN-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide
SMILESCc1nc2cccnc2n1-c1ccc(CCC(=O)NC2CCCCCC2)cc1
InChIInChI=1S/C23H28N4O/c1-17-25-21-9-6-16-24-23(21)27(17)20-13-10-18(11-14-20)12-15-22(28)26-19-7-4-2-3-5-8-19/h6,9-11,13-14,16,19H,2-5,7-8,12,15H2,1H3,(H,26,28)
InChIKeyQYRWNWFNXDNKGB-UHFFFAOYSA-N
MW376.50 g/mol
LogP4.50
Rot. Bonds5

About N-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide

N-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide (PubChem CID 20916237) has the molecular formula C23H28N4O and a molecular weight of 376.50 g/mol. Its IUPAC name is N-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide.

Molecular Properties

Compound NameN-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide
PubChem CID20916237
Molecular FormulaC23H28N4O
Molecular Weight376.50 g/mol
Exact Mass376.23
IUPAC NameN-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide
SMILESCc1nc2cccnc2n1-c1ccc(CCC(=O)NC2CCCCCC2)cc1
InChIInChI=1S/C23H28N4O/c1-17-25-21-9-6-16-24-23(21)27(17)20-13-10-18(11-14-20)12-15-22(28)26-19-7-4-2-3-5-8-19/h6,9-11,13-14,16,19H,2-5,7-8,12,15H2,1H3,(H,26,28)
InChIKeyQYRWNWFNXDNKGB-UHFFFAOYSA-N
XLogP4.50
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
CID 20867515
3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[(3-methylphenyl)methyl]propanamide
CID 46277233
2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propylacetamide
CID 20916146
N-cyclopentyl-3-[3-(2-methoxyethyl)imidazo[4,5-b]pyridin-2-yl]propanamide
CID 126456884
N-cyclohexyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidine-1-carboxamide
CID 53186925
N-cyclopentyl-4-[3-[(4-fluorophenyl)methyl]imidazo[4,5-b]pyridin-2-yl]butanamide
CID 46360158
2-(3-cyclohexylimidazo[4,5-b]pyridin-2-yl)sulfanyl-N-cyclopentylacetamide
CID 3214157
2-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 20916126
3-(4-fluorophenyl)-2-methylimidazo[4,5-b]pyridine
CID 14119097
N-cycloheptyl-3-pyridin-2-ylpropanamide
CID 110389210
N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide
CID 19221387
N-cyclooctyl-3-[4-(methylsulfamoyl)phenyl]propanamide
CID 51180741

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide?
The IUPAC name of N-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide (CID 20916237) is N-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide.
What is the SMILES notation for N-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide?
The canonical SMILES for N-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide is Cc1nc2cccnc2n1-c1ccc(CCC(=O)NC2CCCCCC2)cc1.
What is the InChIKey of N-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide?
The InChIKey is QYRWNWFNXDNKGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O/c1-17-25-21-9-6-16-24-23(21)27(17)20-13-10-18(11-14-20)12-15-22(28)26-19-7-4-2-3-5-8-19/h6,9-11,13-14,16,19H,2-5,7-8,12,15H2,1H3,(H,26,28).
What are the key properties of N-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide?
N-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide has a molecular weight of 376.50 g/mol, XLogP of 4.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-3-[4-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]propanamide is sourced from PubChem (CID 20916237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).