3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide

C17H13Cl2FN4O — CID 162661928

IUPAC3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide
SMILESO=C(NC1CC(F)C1)c1nc2cccnc2n1-c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C17H13Cl2FN4O/c18-12-4-3-11(8-13(12)19)24-15-14(2-1-5-21-15)23-16(24)17(25)22-10-6-9(20)7-10/h1-5,8-10H,6-7H2,(H,22,25)
InChIKeyDXGDAOQZHXJTMZ-UHFFFAOYSA-N
MW379.22 g/mol
LogP3.96
Rot. Bonds3

About 3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide

3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide (PubChem CID 162661928) has the molecular formula C17H13Cl2FN4O and a molecular weight of 379.22 g/mol. Its IUPAC name is 3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide
PubChem CID162661928
Molecular FormulaC17H13Cl2FN4O
Molecular Weight379.22 g/mol
Exact Mass378.05
IUPAC Name3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide
SMILESO=C(NC1CC(F)C1)c1nc2cccnc2n1-c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C17H13Cl2FN4O/c18-12-4-3-11(8-13(12)19)24-15-14(2-1-5-21-15)23-16(24)17(25)22-10-6-9(20)7-10/h1-5,8-10H,6-7H2,(H,22,25)
InChIKeyDXGDAOQZHXJTMZ-UHFFFAOYSA-N
XLogP3.96
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.22
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide 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

N-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 118710459
7,8-Dichloropyrido[1,2-a]benzimidazole
CID 915136
N-(4-chlorophenyl)-2-[2-(2-pyridyl)benzimidazol-1-yl]acetamide
CID 44024165
N-(3,4-dichlorophenyl)-2-[2-(2-pyridyl)benzimidazol-1-yl]acetamide
CID 44024167
3-(3-Chloro-4-methylphenyl)-N-cyclopropyl-3H-imidazo[4,5-b]pyridine-2-carboxamide
CID 90343271
N-Cyclopropyl-3-(3,4-dichlorophenyl)-3H-imidazo[4,5-b]pyridine-2-carboxamide
CID 90343287
N-(4-chlorophenyl)-2-[2-(1H-pyrrol-2-yl)benzimidazol-1-yl]acetamide
CID 136042356
1-amino-N-(4-chlorophenyl)pyrazino[1,2-a]benzimidazole-3-carboxamide
CID 168284907
N-[(1S,2R)-2-[[6-(3-chloroanilino)-9-ethylpurin-2-yl]amino]cyclohexyl]acetamide
CID 137632510
N-(3,4-dichlorophenyl)-1-methyl-4-(pyridin-4-ylmethylamino)-1H-imidazole-5-carboxamide
CID 44439451
6-(5,6-dichlorobenzimidazol-1-yl)-N-piperidin-4-ylpyridin-2-amine
CID 44448943
(S)-3-(4-(1H-imidazol-1-yl)piperidin-1-yl)-1-(2-(5,6-dichloro-1H-benzo[d]imidazol-2-yl)pyrrolidin-1-yl)propan-1-one
CID 53318672

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide?
The IUPAC name of 3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide (CID 162661928) is 3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide?
The canonical SMILES for 3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide is O=C(NC1CC(F)C1)c1nc2cccnc2n1-c1ccc(Cl)c(Cl)c1.
What is the InChIKey of 3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide?
The InChIKey is DXGDAOQZHXJTMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13Cl2FN4O/c18-12-4-3-11(8-13(12)19)24-15-14(2-1-5-21-15)23-16(24)17(25)22-10-6-9(20)7-10/h1-5,8-10H,6-7H2,(H,22,25).
What are the key properties of 3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide?
3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide has a molecular weight of 379.22 g/mol, XLogP of 3.96, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dichlorophenyl)-N-(3-fluorocyclobutyl)imidazo[4,5-b]pyridine-2-carboxamide is sourced from PubChem (CID 162661928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).