5-cyano-N-decylthiophene-2-sulfonamide

C15H24N2O2S2 — CID 106268639

IUPAC5-cyano-N-decylthiophene-2-sulfonamide
SMILESCCCCCCCCCCNS(=O)(=O)c1ccc(C#N)s1
InChIInChI=1S/C15H24N2O2S2/c1-2-3-4-5-6-7-8-9-12-17-21(18,19)15-11-10-14(13-16)20-15/h10-11,17H,2-9,12H2,1H3
InChIKeyZCFQVYIJFOQSJQ-UHFFFAOYSA-N
MW328.50 g/mol
LogP4.04
Rot. Bonds11

About 5-cyano-N-decylthiophene-2-sulfonamide

5-cyano-N-decylthiophene-2-sulfonamide (PubChem CID 106268639) has the molecular formula C15H24N2O2S2 and a molecular weight of 328.50 g/mol. Its IUPAC name is 5-cyano-N-decylthiophene-2-sulfonamide.

Molecular Properties

Compound Name5-cyano-N-decylthiophene-2-sulfonamide
PubChem CID106268639
Molecular FormulaC15H24N2O2S2
Molecular Weight328.50 g/mol
Exact Mass328.13
IUPAC Name5-cyano-N-decylthiophene-2-sulfonamide
SMILESCCCCCCCCCCNS(=O)(=O)c1ccc(C#N)s1
InChIInChI=1S/C15H24N2O2S2/c1-2-3-4-5-6-7-8-9-12-17-21(18,19)15-11-10-14(13-16)20-15/h10-11,17H,2-9,12H2,1H3
InChIKeyZCFQVYIJFOQSJQ-UHFFFAOYSA-N
XLogP4.04
TPSA69.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.50
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-butyl-5-cyanothiophene-2-sulfonamide
CID 106266954
5-cyano-N-(3-methylsulfonylpropyl)thiophene-2-sulfonamide
CID 114166224
5-cyano-N-(2-ethylsulfinylethyl)thiophene-2-sulfonamide
CID 114166393
5-chloro-N-heptylthiophene-2-sulfonamide
CID 19681281
5-methyl-N-pentylthiophene-2-sulfonamide
CID 39791909
2-[(5-cyanothiophen-2-yl)sulfonylamino]-N-propylacetamide
CID 106267367
5-cyano-N-(3-cyclopentylpropyl)thiophene-2-sulfonamide
CID 106269784
4-[(5-cyanothiophen-2-yl)sulfonylamino]-2-methylbutanoic acid
CID 106265760
5-cyano-N-(2,2,2-trifluoroethyl)thiophene-2-sulfonamide
CID 106267146
5-cyano-N-(2-methyl-2-methylsulfonylpropyl)thiophene-2-sulfonamide
CID 106268602
2-[(5-cyanothiophen-2-yl)sulfonylamino]ethyl carbamate
CID 114166352
5-cyano-N-[2-(trifluoromethylsulfanyl)ethyl]thiophene-2-sulfonamide
CID 106428781

Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-decylthiophene-2-sulfonamide?
The IUPAC name of 5-cyano-N-decylthiophene-2-sulfonamide (CID 106268639) is 5-cyano-N-decylthiophene-2-sulfonamide.
What is the SMILES notation for 5-cyano-N-decylthiophene-2-sulfonamide?
The canonical SMILES for 5-cyano-N-decylthiophene-2-sulfonamide is CCCCCCCCCCNS(=O)(=O)c1ccc(C#N)s1.
What is the InChIKey of 5-cyano-N-decylthiophene-2-sulfonamide?
The InChIKey is ZCFQVYIJFOQSJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S2/c1-2-3-4-5-6-7-8-9-12-17-21(18,19)15-11-10-14(13-16)20-15/h10-11,17H,2-9,12H2,1H3.
What are the key properties of 5-cyano-N-decylthiophene-2-sulfonamide?
5-cyano-N-decylthiophene-2-sulfonamide has a molecular weight of 328.50 g/mol, XLogP of 4.04, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-decylthiophene-2-sulfonamide is sourced from PubChem (CID 106268639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).