2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide

C19H14F3N3O — CID 109170627

IUPAC2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide
SMILESO=C(NCc1ccc(F)cc1)c1ccnc(Nc2c(F)cccc2F)c1
InChIInChI=1S/C19H14F3N3O/c20-14-6-4-12(5-7-14)11-24-19(26)13-8-9-23-17(10-13)25-18-15(21)2-1-3-16(18)22/h1-10H,11H2,(H,23,25)(H,24,26)
InChIKeyBNYQHDXMQFBYJJ-UHFFFAOYSA-N
MW357.34 g/mol
LogP4.17
Rot. Bonds5

About 2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide

2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide (PubChem CID 109170627) has the molecular formula C19H14F3N3O and a molecular weight of 357.34 g/mol. Its IUPAC name is 2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide
PubChem CID109170627
Molecular FormulaC19H14F3N3O
Molecular Weight357.34 g/mol
Exact Mass357.11
IUPAC Name2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide
SMILESO=C(NCc1ccc(F)cc1)c1ccnc(Nc2c(F)cccc2F)c1
InChIInChI=1S/C19H14F3N3O/c20-14-6-4-12(5-7-14)11-24-19(26)13-8-9-23-17(10-13)25-18-15(21)2-1-3-16(18)22/h1-10H,11H2,(H,23,25)(H,24,26)
InChIKeyBNYQHDXMQFBYJJ-UHFFFAOYSA-N
XLogP4.17
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.34
LogP ≤ 54.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-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

6-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyrimidine-4-carboxamide
CID 109348491
N-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide
CID 109170915
2-[2-(2-fluorophenyl)ethylamino]-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide
CID 109170555
2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide
CID 109176900
4-N-[(2-fluorophenyl)methyl]-2-N-[(4-fluorophenyl)methyl]pyridine-2,4-dicarboxamide
CID 109086328
4-N-benzyl-2-N-[(4-fluorophenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085281
2-(2,4-difluoroanilino)-N-[(3-methylphenyl)methyl]pyridine-4-carboxamide
CID 109169816
N-[(4-fluorophenyl)methyl]-2-[(4-methoxyphenyl)methylamino]pyridine-4-carboxamide
CID 109170550
2-(3,4-difluoroanilino)-N-[(4-methylphenyl)methyl]pyridine-4-carboxamide
CID 109169969
N-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide
CID 109178580
4-N-[2-(4-fluorophenyl)ethyl]-2-N-[(4-fluorophenyl)methyl]pyridine-2,4-dicarboxamide
CID 109086566
2-[(4-fluorophenyl)methylamino]-N-(3-phenylpropyl)pyridine-4-carboxamide
CID 109170654

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide?
The IUPAC name of 2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide (CID 109170627) is 2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide?
The canonical SMILES for 2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide is O=C(NCc1ccc(F)cc1)c1ccnc(Nc2c(F)cccc2F)c1.
What is the InChIKey of 2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide?
The InChIKey is BNYQHDXMQFBYJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3N3O/c20-14-6-4-12(5-7-14)11-24-19(26)13-8-9-23-17(10-13)25-18-15(21)2-1-3-16(18)22/h1-10H,11H2,(H,23,25)(H,24,26).
What are the key properties of 2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide?
2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide has a molecular weight of 357.34 g/mol, XLogP of 4.17, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 109170627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).