N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide

C15H10F2N4O — CID 166481211

IUPACN-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1cccc(-n2ccnc2)n1
InChIInChI=1S/C15H10F2N4O/c16-11-5-4-10(8-12(11)17)19-15(22)13-2-1-3-14(20-13)21-7-6-18-9-21/h1-9H,(H,19,22)
InChIKeyWDCVHFZCDANTCX-UHFFFAOYSA-N
MW300.27 g/mol
LogP2.80
Rot. Bonds3

About N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide

N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide (PubChem CID 166481211) has the molecular formula C15H10F2N4O and a molecular weight of 300.27 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide
PubChem CID166481211
Molecular FormulaC15H10F2N4O
Molecular Weight300.27 g/mol
Exact Mass300.08
IUPAC NameN-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1cccc(-n2ccnc2)n1
InChIInChI=1S/C15H10F2N4O/c16-11-5-4-10(8-12(11)17)19-15(22)13-2-1-3-14(20-13)21-7-6-18-9-21/h1-9H,(H,19,22)
InChIKeyWDCVHFZCDANTCX-UHFFFAOYSA-N
XLogP2.80
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.27
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-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

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide?
The IUPAC name of N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide (CID 166481211) is N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide?
The canonical SMILES for N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide is O=C(Nc1ccc(F)c(F)c1)c1cccc(-n2ccnc2)n1.
What is the InChIKey of N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide?
The InChIKey is WDCVHFZCDANTCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F2N4O/c16-11-5-4-10(8-12(11)17)19-15(22)13-2-1-3-14(20-13)21-7-6-18-9-21/h1-9H,(H,19,22).
What are the key properties of N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide?
N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide has a molecular weight of 300.27 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide is sourced from PubChem (CID 166481211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).