5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide

C15H10N2O2S2 — CID 106266893

IUPAC5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)Nc2cccc3ccccc23)s1
InChIInChI=1S/C15H10N2O2S2/c16-10-12-8-9-15(20-12)21(18,19)17-14-7-3-5-11-4-1-2-6-13(11)14/h1-9,17H
InChIKeyALYIHJXXIIPQHA-UHFFFAOYSA-N
MW314.39 g/mol
LogP3.57
Rot. Bonds3

About 5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide

5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide (PubChem CID 106266893) has the molecular formula C15H10N2O2S2 and a molecular weight of 314.39 g/mol. Its IUPAC name is 5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide.

Molecular Properties

Compound Name5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide
PubChem CID106266893
Molecular FormulaC15H10N2O2S2
Molecular Weight314.39 g/mol
Exact Mass314.02
IUPAC Name5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)Nc2cccc3ccccc23)s1
InChIInChI=1S/C15H10N2O2S2/c16-10-12-8-9-15(20-12)21(18,19)17-14-7-3-5-11-4-1-2-6-13(11)14/h1-9,17H
InChIKeyALYIHJXXIIPQHA-UHFFFAOYSA-N
XLogP3.57
TPSA69.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-cyano-N-(2-methylsulfanylphenyl)thiophene-2-sulfonamide
CID 106269401
N-(2-bromo-3-chlorophenyl)-5-cyanothiophene-2-sulfonamide
CID 106269296
3-[(5-cyanothiophen-2-yl)sulfonylamino]-2-hydroxybenzoic acid
CID 106265871
5-cyano-N-(1H-indazol-3-yl)thiophene-2-sulfonamide
CID 106272595
5-cyano-N-quinolin-3-ylthiophene-2-sulfonamide
CID 106268092
N-(6-chloro-2-methyl-3-pyridinyl)-5-cyanothiophene-2-sulfonamide
CID 106273443
5-cyano-N-[3-(hydroxymethyl)phenyl]thiophene-2-sulfonamide
CID 106272386
N-(2-bromo-5-chlorophenyl)-5-cyanothiophene-2-sulfonamide
CID 106268722
5-cyano-N-(4-hydroxyphenyl)thiophene-2-sulfonamide
CID 106269600
5-cyano-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide
CID 106272305
N-(2-bromo-4-fluorophenyl)-5-cyanothiophene-2-sulfonamide
CID 106267209
5-cyano-N-(5-methyl-1H-1,2,4-triazol-3-yl)thiophene-2-sulfonamide
CID 114166841

Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide?
The IUPAC name of 5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide (CID 106266893) is 5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide.
What is the SMILES notation for 5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide?
The canonical SMILES for 5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide is N#Cc1ccc(S(=O)(=O)Nc2cccc3ccccc23)s1.
What is the InChIKey of 5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide?
The InChIKey is ALYIHJXXIIPQHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O2S2/c16-10-12-8-9-15(20-12)21(18,19)17-14-7-3-5-11-4-1-2-6-13(11)14/h1-9,17H.
What are the key properties of 5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide?
5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide has a molecular weight of 314.39 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-naphthalen-1-ylthiophene-2-sulfonamide is sourced from PubChem (CID 106266893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).