2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide

C15H16F2N2O2S — CID 146143709

IUPAC2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide
SMILESCCN(c1cccnc1C)S(=O)(=O)c1ccccc1C(F)F
InChIInChI=1S/C15H16F2N2O2S/c1-3-19(13-8-6-10-18-11(13)2)22(20,21)14-9-5-4-7-12(14)15(16)17/h4-10,15H,3H2,1-2H3
InChIKeySDVQVGOOPHDKLH-UHFFFAOYSA-N
MW326.37 g/mol
LogP3.54
Rot. Bonds5

About 2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide

2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide (PubChem CID 146143709) has the molecular formula C15H16F2N2O2S and a molecular weight of 326.37 g/mol. Its IUPAC name is 2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide
PubChem CID146143709
Molecular FormulaC15H16F2N2O2S
Molecular Weight326.37 g/mol
Exact Mass326.09
IUPAC Name2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide
SMILESCCN(c1cccnc1C)S(=O)(=O)c1ccccc1C(F)F
InChIInChI=1S/C15H16F2N2O2S/c1-3-19(13-8-6-10-18-11(13)2)22(20,21)14-9-5-4-7-12(14)15(16)17/h4-10,15H,3H2,1-2H3
InChIKeySDVQVGOOPHDKLH-UHFFFAOYSA-N
XLogP3.54
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.37
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3-fluoro-N-(2-fluorophenyl)pyridine-2-sulfonamide
CID 103299977
2-(cyclopropylmethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)pyrazole-3-sulfonamide
CID 155956923
2-chloro-N-ethyl-N-(3-hydroxyphenyl)pyridine-3-sulfonamide
CID 103223846
N-(2-ethoxyphenyl)-N-ethyl-4-methylbenzenesulfonamide
CID 35767256
ethane;(1S)-1-(2-methyl-3-pyridinyl)propan-1-ol
CID 144739559
2-amino-N,N-diethylpyridine-3-sulfonamide
CID 62150875
N-(2-aminophenyl)-N-ethyl-1,1-difluoromethanesulfonamide
CID 62102958
N-(2-aminophenyl)-N-ethyl-2,4-difluorobenzenesulfonamide
CID 62101650
N-decyl-2-ethyl-N-quinolin-8-ylbenzenesulfonamide
CID 70592370
N-ethyl-N-(2-hydroxyphenyl)-4-methylbenzenesulfonamide
CID 14196335
N,N-bis(2-methyl-3-pyridinyl)acetamide
CID 123651187
(1R)-2-amino-1-(2-methyl-3-pyridinyl)ethanol
CID 96635768

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide?
The IUPAC name of 2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide (CID 146143709) is 2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide?
The canonical SMILES for 2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide is CCN(c1cccnc1C)S(=O)(=O)c1ccccc1C(F)F.
What is the InChIKey of 2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide?
The InChIKey is SDVQVGOOPHDKLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2N2O2S/c1-3-19(13-8-6-10-18-11(13)2)22(20,21)14-9-5-4-7-12(14)15(16)17/h4-10,15H,3H2,1-2H3.
What are the key properties of 2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide?
2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide has a molecular weight of 326.37 g/mol, XLogP of 3.54, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-N-ethyl-N-(2-methyl-3-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 146143709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).