N-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide

C15H10FN3O2S2 — CID 167206651

IUPACN-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide
SMILESN#Cc1ccc(NS(=O)(=O)c2c[nH]c(-c3ccsc3)c2)c(F)c1
InChIInChI=1S/C15H10FN3O2S2/c16-13-5-10(7-17)1-2-14(13)19-23(20,21)12-6-15(18-8-12)11-3-4-22-9-11/h1-6,8-9,18-19H
InChIKeyICAYQHIZCHPNKP-UHFFFAOYSA-N
MW347.40 g/mol
LogP3.55
Rot. Bonds4

About N-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide

N-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide (PubChem CID 167206651) has the molecular formula C15H10FN3O2S2 and a molecular weight of 347.40 g/mol. Its IUPAC name is N-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide.

Molecular Properties

Compound NameN-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide
PubChem CID167206651
Molecular FormulaC15H10FN3O2S2
Molecular Weight347.40 g/mol
Exact Mass347.02
IUPAC NameN-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide
SMILESN#Cc1ccc(NS(=O)(=O)c2c[nH]c(-c3ccsc3)c2)c(F)c1
InChIInChI=1S/C15H10FN3O2S2/c16-13-5-10(7-17)1-2-14(13)19-23(20,21)12-6-15(18-8-12)11-3-4-22-9-11/h1-6,8-9,18-19H
InChIKeyICAYQHIZCHPNKP-UHFFFAOYSA-N
XLogP3.55
TPSA85.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.40
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide 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-(4-cyano-2-fluorophenyl)-5-pyridin-3-yl-1H-pyrrole-3-sulfonamide
CID 166153637
N-(5-cyano-3-fluoro-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 61274022
3-bromo-4-chloro-N-(4-cyano-2-fluorophenyl)benzenesulfonamide
CID 106605845
N-(4-cyano-2-fluorophenyl)-4-(4-fluorophenyl)-1H-pyrrole-3-sulfonamide
CID 166153747
2-tert-butyl-N-(4-cyano-2-fluorophenyl)-4H-thieno[3,2-b]pyrrole-6-sulfonamide
CID 171650317
4-benzyl-N-(4-cyano-2-fluorophenyl)-5-fluoro-1H-pyrrole-3-sulfonamide
CID 166153238
5-chloro-N-(4-cyano-2-fluorophenyl)-4-methylthiophene-2-sulfonamide
CID 103099977
3-cyano-N-(2,4,5-trifluorophenyl)benzenesulfonamide
CID 62815564
N-(2-amino-4-cyanophenyl)-3,4-difluorobenzenesulfonamide
CID 78965177
N-(4-cyano-2-fluorophenyl)-2-methylpyrazole-3-sulfonamide
CID 115744817
3-cyano-N-(2,3-difluorophenyl)benzenesulfonamide
CID 47336983
N-(4-cyano-2-fluorophenyl)-2-oxo-1,3-oxazolidine-3-sulfonamide
CID 168962959

Frequently Asked Questions

What is the IUPAC name of N-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide?
The IUPAC name of N-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide (CID 167206651) is N-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide.
What is the SMILES notation for N-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide?
The canonical SMILES for N-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide is N#Cc1ccc(NS(=O)(=O)c2c[nH]c(-c3ccsc3)c2)c(F)c1.
What is the InChIKey of N-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide?
The InChIKey is ICAYQHIZCHPNKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FN3O2S2/c16-13-5-10(7-17)1-2-14(13)19-23(20,21)12-6-15(18-8-12)11-3-4-22-9-11/h1-6,8-9,18-19H.
What are the key properties of N-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide?
N-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide has a molecular weight of 347.40 g/mol, XLogP of 3.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyano-2-fluorophenyl)-5-thiophen-3-yl-1H-pyrrole-3-sulfonamide is sourced from PubChem (CID 167206651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).