N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide

C24H29FN4O — CID 18734085

IUPACN-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide
SMILESCc1c(F)cccc1C(=O)N(Cc1nc2cccnc2n1C1CCCC1)CC(C)C
InChIInChI=1S/C24H29FN4O/c1-16(2)14-28(24(30)19-10-6-11-20(25)17(19)3)15-22-27-21-12-7-13-26-23(21)29(22)18-8-4-5-9-18/h6-7,10-13,16,18H,4-5,8-9,14-15H2,1-3H3
InChIKeyIRFJLYSBOOMUKQ-UHFFFAOYSA-N
MW408.52 g/mol
LogP5.29
Rot. Bonds6

About N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide

N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide (PubChem CID 18734085) has the molecular formula C24H29FN4O and a molecular weight of 408.52 g/mol. Its IUPAC name is N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound NameN-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide
PubChem CID18734085
Molecular FormulaC24H29FN4O
Molecular Weight408.52 g/mol
Exact Mass408.23
IUPAC NameN-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide
SMILESCc1c(F)cccc1C(=O)N(Cc1nc2cccnc2n1C1CCCC1)CC(C)C
InChIInChI=1S/C24H29FN4O/c1-16(2)14-28(24(30)19-10-6-11-20(25)17(19)3)15-22-27-21-12-7-13-26-23(21)29(22)18-8-4-5-9-18/h6-7,10-13,16,18H,4-5,8-9,14-15H2,1-3H3
InChIKeyIRFJLYSBOOMUKQ-UHFFFAOYSA-N
XLogP5.29
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.52
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide 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
Acalabrutinib
CID 71226662
AR-H047108
CID 9864291
IC 87114
CID 9908783
(3R)-1-(2-(1-((4-fluorophenyl)methyl)-1H-indol-2-yl)-3-methylimidazo(1,2-a)pyridine-7-carbonyl)piperidin-3-amine
CID 138578805
7-(2-(1H-Imidazol-1-yl)-5-methylimidazo(1,5-b)pyridazin-7-yl)-1-phenyl-1-heptanone
CID 189892
2-fluoro-4-(4-(1-isopropyl-2-methyl-1H-imidazol-5-yl)pyrimidin-2-ylamino)-N-methylbenzamide
CID 11675054
4-[8-Azanyl-3-[(3~{r},6~{s})-1-Cyclopropylcarbonyl-6-Methyl-Piperidin-3-Yl]imidazo[1,5-A]pyrazin-1-Yl]-3-Fluoranyl-~{n}-[4-(Trifluoromethyl)pyridin-2-Yl]benzamide
CID 71226367
N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
CID 748028
N-(4-(((3S)-3-(dimethylamino)pyrrolidin-1-yl)carbonyl)phenyl)-5-fluoro-4-(2-methyl-1-(1-methylethyl)-1H-imidazol-5-yl)pyrimidin-2-amine
CID 16113377
N-[3-(2-acetamidoimidazo[1,2-a]pyridin-6-yl)-4-methylphenyl]-3-(trifluoromethyl)benzamide
CID 56929808
7-[5-Methyl-2-(1-pyrrolyl)imidazo[1,5-b]pyridazin-7-yl]-1-phenyl-1-heptanone
CID 455585

Frequently Asked Questions

What is the IUPAC name of N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide?
The IUPAC name of N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide (CID 18734085) is N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide.
What is the SMILES notation for N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide?
The canonical SMILES for N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide is Cc1c(F)cccc1C(=O)N(Cc1nc2cccnc2n1C1CCCC1)CC(C)C.
What is the InChIKey of N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide?
The InChIKey is IRFJLYSBOOMUKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29FN4O/c1-16(2)14-28(24(30)19-10-6-11-20(25)17(19)3)15-22-27-21-12-7-13-26-23(21)29(22)18-8-4-5-9-18/h6-7,10-13,16,18H,4-5,8-9,14-15H2,1-3H3.
What are the key properties of N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide?
N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide has a molecular weight of 408.52 g/mol, XLogP of 5.29, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-cyclopentylimidazo[4,5-b]pyridin-2-yl)methyl]-3-fluoro-2-methyl-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 18734085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).