N-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide

C15H10FN3O2S — CID 135187095

IUPACN-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide
SMILESN#Cc1ccc(NS(=O)(=O)c2c[nH]c3cc(F)ccc23)cc1
InChIInChI=1S/C15H10FN3O2S/c16-11-3-6-13-14(7-11)18-9-15(13)22(20,21)19-12-4-1-10(8-17)2-5-12/h1-7,9,18-19H
InChIKeyAFKGFFFCHABPDY-UHFFFAOYSA-N
MW315.33 g/mol
LogP2.98
Rot. Bonds3

About N-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide

N-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide (PubChem CID 135187095) has the molecular formula C15H10FN3O2S and a molecular weight of 315.33 g/mol. Its IUPAC name is N-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide
PubChem CID135187095
Molecular FormulaC15H10FN3O2S
Molecular Weight315.33 g/mol
Exact Mass315.05
IUPAC NameN-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide
SMILESN#Cc1ccc(NS(=O)(=O)c2c[nH]c3cc(F)ccc23)cc1
InChIInChI=1S/C15H10FN3O2S/c16-11-3-6-13-14(7-11)18-9-15(13)22(20,21)19-12-4-1-10(8-17)2-5-12/h1-7,9,18-19H
InChIKeyAFKGFFFCHABPDY-UHFFFAOYSA-N
XLogP2.98
TPSA85.75 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.33
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-fluoro-N-(2,4,5-trifluorophenyl)-1H-indole-3-sulfonamide
CID 135201111
6-fluoro-N-(2-fluoro-4-iodophenyl)-1H-indole-3-sulfonamide
CID 142393306
6-chloro-N-(4-cyanophenyl)-1H-pyrrolo[2,3-b]pyridine-3-sulfonamide
CID 135191770
5-amino-N-(4-fluorophenyl)-1H-indole-3-sulfonamide
CID 64853032
N-(4-ethynylphenyl)-6-methylsulfonyl-1H-indole-3-sulfonamide
CID 135188134
N-[3-[(4-cyanophenyl)methylsulfonyl]-1H-indol-6-yl]methanesulfonamide
CID 71179158
6-chloro-N-(2-cyano-5-fluorophenyl)-1H-indole-3-sulfonamide;6-chloro-N-(3-oxo-1H-2-benzofuran-5-yl)-1H-indole-3-sulfonamide
CID 159605079
6-(4-cyanophenyl)-1H-indole-3-sulfonamide
CID 174968242
6-chloro-N-(4-cyano-2,5-difluorophenyl)-1H-indole-3-sulfonamide
CID 135188166
N-(4-cyanophenyl)-4-fluoro-2,6-dimethylbenzenesulfonamide
CID 107326514
N-(4-cyano-2-fluorophenyl)-6-phenylmethoxy-1H-indole-3-sulfonamide
CID 142393412
N-[4-(aminomethyl)phenyl]-6-bromo-1H-indole-3-sulfonamide
CID 153279331

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide?
The IUPAC name of N-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide (CID 135187095) is N-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide.
What is the SMILES notation for N-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide?
The canonical SMILES for N-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide is N#Cc1ccc(NS(=O)(=O)c2c[nH]c3cc(F)ccc23)cc1.
What is the InChIKey of N-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide?
The InChIKey is AFKGFFFCHABPDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FN3O2S/c16-11-3-6-13-14(7-11)18-9-15(13)22(20,21)19-12-4-1-10(8-17)2-5-12/h1-7,9,18-19H.
What are the key properties of N-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide?
N-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide has a molecular weight of 315.33 g/mol, XLogP of 2.98, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-6-fluoro-1H-indole-3-sulfonamide is sourced from PubChem (CID 135187095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).