2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide

C24H19ClF2N4O2 — CID 71118566

IUPAC2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide
SMILESCN(Cc1ccncc1)C(=O)c1cnc(OCc2c(F)cccc2Cl)n1-c1ccc(F)cc1
InChIInChI=1S/C24H19ClF2N4O2/c1-30(14-16-9-11-28-12-10-16)23(32)22-13-29-24(31(22)18-7-5-17(26)6-8-18)33-15-19-20(25)3-2-4-21(19)27/h2-13H,14-15H2,1H3
InChIKeyDBNRHTYIJDYNEF-UHFFFAOYSA-N
MW468.89 g/mol
LogP5.05
Rot. Bonds7

About 2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide

2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide (PubChem CID 71118566) has the molecular formula C24H19ClF2N4O2 and a molecular weight of 468.89 g/mol. Its IUPAC name is 2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide.

Molecular Properties

Compound Name2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide
PubChem CID71118566
Molecular FormulaC24H19ClF2N4O2
Molecular Weight468.89 g/mol
Exact Mass468.12
IUPAC Name2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide
SMILESCN(Cc1ccncc1)C(=O)c1cnc(OCc2c(F)cccc2Cl)n1-c1ccc(F)cc1
InChIInChI=1S/C24H19ClF2N4O2/c1-30(14-16-9-11-28-12-10-16)23(32)22-13-29-24(31(22)18-7-5-17(26)6-8-18)33-15-19-20(25)3-2-4-21(19)27/h2-13H,14-15H2,1H3
InChIKeyDBNRHTYIJDYNEF-UHFFFAOYSA-N
XLogP5.05
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.89
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-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

3-(4-fluorophenyl)-N-methyl-2-[2-methyl-1-(2,3,6-trifluorophenyl)propan-2-yl]-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide
CID 71117976
3-[2-(2-chloro-6-fluorophenyl)ethyl]-1-methyl-1-(pyridin-4-ylmethyl)urea
CID 71969304
N-[(3,4-dichlorophenyl)methyl]-3-(4-fluorophenyl)-N-methyl-2-methylsulfanylimidazole-4-carboxamide
CID 16546636
N-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-4-pyrazol-1-ylbenzamide
CID 9171384
2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide
CID 62649865
2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-5-(2,2-dimethylpropyl)-N-methyl-N-(pyridin-4-ylmethyl)-1H-imidazole-4-carboxamide
CID 123141256
5,6-dichloro-N-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 43564503
2-amino-3-fluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide
CID 62662222
3-(4-fluorophenyl)-N-methyl-2-methylsulfanyl-N-(pyridin-2-ylmethyl)imidazole-4-carboxamide
CID 55957769
2,3-dichloro-N-[(4-fluorophenyl)methyl]-N-methylbenzamide
CID 112792625
5-chloro-2-fluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide
CID 53016447
2-[(2,6-dichlorophenyl)sulfanylmethyl]-N-[(1,3-dimethylpyrazol-4-yl)methyl]-3-(4-fluorophenyl)-N-methylimidazole-4-carboxamide
CID 71117797

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide?
The IUPAC name of 2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide (CID 71118566) is 2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide.
What is the SMILES notation for 2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide?
The canonical SMILES for 2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide is CN(Cc1ccncc1)C(=O)c1cnc(OCc2c(F)cccc2Cl)n1-c1ccc(F)cc1.
What is the InChIKey of 2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide?
The InChIKey is DBNRHTYIJDYNEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19ClF2N4O2/c1-30(14-16-9-11-28-12-10-16)23(32)22-13-29-24(31(22)18-7-5-17(26)6-8-18)33-15-19-20(25)3-2-4-21(19)27/h2-13H,14-15H2,1H3.
What are the key properties of 2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide?
2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide has a molecular weight of 468.89 g/mol, XLogP of 5.05, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chloro-6-fluorophenyl)methoxy]-3-(4-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazole-4-carboxamide is sourced from PubChem (CID 71118566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).