N-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide

C19H12F2N4O — CID 109165005

IUPACN-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide
SMILESN#Cc1cccc(NC(=O)c2ccc(Nc3ccc(F)c(F)c3)nc2)c1
InChIInChI=1S/C19H12F2N4O/c20-16-6-5-15(9-17(16)21)24-18-7-4-13(11-23-18)19(26)25-14-3-1-2-12(8-14)10-22/h1-9,11H,(H,23,24)(H,25,26)
InChIKeyHYHPSAVZNBAHSH-UHFFFAOYSA-N
MW350.33 g/mol
LogP4.23
Rot. Bonds4

About N-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide

N-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide (PubChem CID 109165005) has the molecular formula C19H12F2N4O and a molecular weight of 350.33 g/mol. Its IUPAC name is N-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide
PubChem CID109165005
Molecular FormulaC19H12F2N4O
Molecular Weight350.33 g/mol
Exact Mass350.10
IUPAC NameN-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide
SMILESN#Cc1cccc(NC(=O)c2ccc(Nc3ccc(F)c(F)c3)nc2)c1
InChIInChI=1S/C19H12F2N4O/c20-16-6-5-15(9-17(16)21)24-18-7-4-13(11-23-18)19(26)25-14-3-1-2-12(8-14)10-22/h1-9,11H,(H,23,24)(H,25,26)
InChIKeyHYHPSAVZNBAHSH-UHFFFAOYSA-N
XLogP4.23
TPSA77.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.33
LogP ≤ 54.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(4-tert-butylanilino)-N-(3-cyanophenyl)pyridine-3-carboxamide
CID 109163157
N-(2-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide
CID 109164997
N-(3-cyanophenyl)-6-(4-pyrrolidin-1-ylanilino)pyridine-3-carboxamide
CID 109164713
N-(2-bromophenyl)-6-(3-cyanoanilino)pyridine-3-carboxamide
CID 109164780
N-(4-cyanophenyl)-6-[3-(trifluoromethyl)anilino]pyridine-3-carboxamide
CID 109164420
2-chloro-N-[6-(3-cyanoanilino)-3-pyridinyl]-6-fluorobenzamide
CID 113022787
N-[6-(3-cyanoanilino)-3-pyridinyl]-3,4-dimethoxybenzamide
CID 113022770
6-(3-chloro-2-methylanilino)-N-(3-cyanophenyl)pyridine-3-carboxamide
CID 109163549
6-(3,4-difluoroanilino)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109164202
N-(3,4-difluorophenyl)-6-(4-ethylanilino)pyridine-3-carboxamide
CID 109162873
4-N-(3-cyanophenyl)-1-N-(4-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049931
N-(3-chloro-4-methoxyphenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide
CID 109163790

Frequently Asked Questions

What is the IUPAC name of N-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide?
The IUPAC name of N-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide (CID 109165005) is N-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide is N#Cc1cccc(NC(=O)c2ccc(Nc3ccc(F)c(F)c3)nc2)c1.
What is the InChIKey of N-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide?
The InChIKey is HYHPSAVZNBAHSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F2N4O/c20-16-6-5-15(9-17(16)21)24-18-7-4-13(11-23-18)19(26)25-14-3-1-2-12(8-14)10-22/h1-9,11H,(H,23,24)(H,25,26).
What are the key properties of N-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide?
N-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide has a molecular weight of 350.33 g/mol, XLogP of 4.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109165005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).