N-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide

C15H14F2N2OS — CID 1486221

IUPACN-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide
SMILESCC(C)Sc1ccc(C(=O)Nc2ccc(F)cc2F)cn1
InChIInChI=1S/C15H14F2N2OS/c1-9(2)21-14-6-3-10(8-18-14)15(20)19-13-5-4-11(16)7-12(13)17/h3-9H,1-2H3,(H,19,20)
InChIKeyJJJUYBQCDVHCFY-UHFFFAOYSA-N
MW308.35 g/mol
LogP4.11
Rot. Bonds4

About N-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide

N-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide (PubChem CID 1486221) has the molecular formula C15H14F2N2OS and a molecular weight of 308.35 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide
PubChem CID1486221
Molecular FormulaC15H14F2N2OS
Molecular Weight308.35 g/mol
Exact Mass308.08
IUPAC NameN-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide
SMILESCC(C)Sc1ccc(C(=O)Nc2ccc(F)cc2F)cn1
InChIInChI=1S/C15H14F2N2OS/c1-9(2)21-14-6-3-10(8-18-14)15(20)19-13-5-4-11(16)7-12(13)17/h3-9H,1-2H3,(H,19,20)
InChIKeyJJJUYBQCDVHCFY-UHFFFAOYSA-N
XLogP4.11
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.35
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-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-(2,4-difluorophenyl)-2-(propan-2-ylamino)pyrimidine-5-carboxamide
CID 109247233
1-N,4-N-bis(2,4-difluorophenyl)benzene-1,4-dicarboxamide
CID 3596826
N-(2,4-difluorophenyl)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 33164256
4-N-butan-2-yl-1-N-(2,4-difluorophenyl)benzene-1,4-dicarboxamide
CID 109044182
6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide
CID 109164503
N-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 109162562
N-(2,4-difluorophenyl)-4-propan-2-ylsulfonylbenzamide
CID 41148674
N-(2,4-difluorophenyl)-4-ethylbenzamide
CID 2478391
N-(2,4-difluorophenyl)-6-pyrazol-1-ylpyridine-3-carboxamide
CID 3567091
N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide
CID 966752
2-N-(2,4-difluorophenyl)-4-N-propan-2-ylpyridine-2,4-dicarboxamide
CID 109078181
N-(2,4-difluorophenyl)-1-methylpyrazole-4-carboxamide
CID 9209583

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide (CID 1486221) is N-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide is CC(C)Sc1ccc(C(=O)Nc2ccc(F)cc2F)cn1.
What is the InChIKey of N-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide?
The InChIKey is JJJUYBQCDVHCFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2OS/c1-9(2)21-14-6-3-10(8-18-14)15(20)19-13-5-4-11(16)7-12(13)17/h3-9H,1-2H3,(H,19,20).
What are the key properties of N-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide?
N-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide has a molecular weight of 308.35 g/mol, XLogP of 4.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-6-propan-2-ylsulfanylpyridine-3-carboxamide is sourced from PubChem (CID 1486221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).