N-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide

C12H7ClFN3O2S — CID 103299415

IUPACN-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide
SMILESN#Cc1cc(NS(=O)(=O)c2ncccc2F)ccc1Cl
InChIInChI=1S/C12H7ClFN3O2S/c13-10-4-3-9(6-8(10)7-15)17-20(18,19)12-11(14)2-1-5-16-12/h1-6,17H
InChIKeyHGPWJJISDHVVSK-UHFFFAOYSA-N
MW311.73 g/mol
LogP2.55
Rot. Bonds3

About N-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide

N-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide (PubChem CID 103299415) has the molecular formula C12H7ClFN3O2S and a molecular weight of 311.73 g/mol. Its IUPAC name is N-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide
PubChem CID103299415
Molecular FormulaC12H7ClFN3O2S
Molecular Weight311.73 g/mol
Exact Mass310.99
IUPAC NameN-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide
SMILESN#Cc1cc(NS(=O)(=O)c2ncccc2F)ccc1Cl
InChIInChI=1S/C12H7ClFN3O2S/c13-10-4-3-9(6-8(10)7-15)17-20(18,19)12-11(14)2-1-5-16-12/h1-6,17H
InChIKeyHGPWJJISDHVVSK-UHFFFAOYSA-N
XLogP2.55
TPSA82.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.73
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide
CID 103299127
N-(3-cyano-4-fluorophenyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103301404
2-chloro-4-[(3-fluoro-2-pyridinyl)sulfonylamino]benzoic acid
CID 103298758
N-(2-chloro-4-cyanophenyl)-3-fluoropyridine-2-sulfonamide
CID 107807709
3-fluoro-N-naphthalen-2-ylpyridine-2-sulfonamide
CID 103299396
2-chloro-N-(4-chloro-3-cyanophenyl)pyrimidine-5-sulfonamide
CID 61053173
4-[(3-fluoro-2-pyridinyl)sulfonylamino]benzamide
CID 103299122
N-(3-acetylphenyl)-3-fluoropyridine-2-sulfonamide
CID 103299384
4-[(3-fluoro-2-pyridinyl)sulfonylamino]benzenecarbothioamide
CID 103300634
3-[(3-fluoro-2-pyridinyl)sulfonylamino]benzenecarbothioamide
CID 103300636
N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide
CID 24831422
N-(2,3-dichlorophenyl)-3-fluoropyridine-2-sulfonamide
CID 103299163

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide?
The IUPAC name of N-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide (CID 103299415) is N-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide.
What is the SMILES notation for N-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide?
The canonical SMILES for N-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide is N#Cc1cc(NS(=O)(=O)c2ncccc2F)ccc1Cl.
What is the InChIKey of N-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide?
The InChIKey is HGPWJJISDHVVSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7ClFN3O2S/c13-10-4-3-9(6-8(10)7-15)17-20(18,19)12-11(14)2-1-5-16-12/h1-6,17H.
What are the key properties of N-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide?
N-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide has a molecular weight of 311.73 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide is sourced from PubChem (CID 103299415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).