5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide

C14H9N3O2S2 — CID 106268086

IUPAC5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)Nc2ccc3ncccc3c2)s1
InChIInChI=1S/C14H9N3O2S2/c15-9-12-4-6-14(20-12)21(18,19)17-11-3-5-13-10(8-11)2-1-7-16-13/h1-8,17H
InChIKeyDMCLNQHGNPLSEJ-UHFFFAOYSA-N
MW315.38 g/mol
LogP2.97
Rot. Bonds3

About 5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide

5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide (PubChem CID 106268086) has the molecular formula C14H9N3O2S2 and a molecular weight of 315.38 g/mol. Its IUPAC name is 5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide.

Molecular Properties

Compound Name5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide
PubChem CID106268086
Molecular FormulaC14H9N3O2S2
Molecular Weight315.38 g/mol
Exact Mass315.01
IUPAC Name5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)Nc2ccc3ncccc3c2)s1
InChIInChI=1S/C14H9N3O2S2/c15-9-12-4-6-14(20-12)21(18,19)17-11-3-5-13-10(8-11)2-1-7-16-13/h1-8,17H
InChIKeyDMCLNQHGNPLSEJ-UHFFFAOYSA-N
XLogP2.97
TPSA82.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-cyano-N-quinolin-3-ylthiophene-2-sulfonamide
CID 106268092
3-[(5-cyanothiophen-2-yl)sulfonylamino]benzoic acid
CID 106265350
2-chloro-N-quinolin-6-ylbenzenesulfonamide
CID 25040814
N-(4-amino-3-methylphenyl)-5-cyanothiophene-2-sulfonamide
CID 106265196
5-cyano-N-(4-hydroxyphenyl)thiophene-2-sulfonamide
CID 106269600
5-cyano-N-(3-iodo-4-methylphenyl)thiophene-2-sulfonamide
CID 114189417
N-(3-chloro-4-fluorophenyl)-5-cyanothiophene-2-sulfonamide
CID 106267208
N-(3-chloro-4-hydroxyphenyl)-5-cyanothiophene-2-sulfonamide
CID 106272309
5-cyano-N-[3-(hydroxymethyl)phenyl]thiophene-2-sulfonamide
CID 106272386
methyl 3-[(5-cyanothiophen-2-yl)sulfonylamino]benzoate
CID 106273151
6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide
CID 62636555
N-quinolin-6-ylethanesulfonamide
CID 64584546

Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide?
The IUPAC name of 5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide (CID 106268086) is 5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide.
What is the SMILES notation for 5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide?
The canonical SMILES for 5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide is N#Cc1ccc(S(=O)(=O)Nc2ccc3ncccc3c2)s1.
What is the InChIKey of 5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide?
The InChIKey is DMCLNQHGNPLSEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9N3O2S2/c15-9-12-4-6-14(20-12)21(18,19)17-11-3-5-13-10(8-11)2-1-7-16-13/h1-8,17H.
What are the key properties of 5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide?
5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide has a molecular weight of 315.38 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide is sourced from PubChem (CID 106268086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).