5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide

C12H16N2O2S2 — CID 106267297

IUPAC5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide
SMILESCC1CCCC(NS(=O)(=O)c2ccc(C#N)s2)C1
InChIInChI=1S/C12H16N2O2S2/c1-9-3-2-4-10(7-9)14-18(15,16)12-6-5-11(8-13)17-12/h5-6,9-10,14H,2-4,7H2,1H3
InChIKeyFAMDBZYJOWSAQE-UHFFFAOYSA-N
MW284.41 g/mol
LogP2.48
Rot. Bonds3

About 5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide

5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide (PubChem CID 106267297) has the molecular formula C12H16N2O2S2 and a molecular weight of 284.41 g/mol. Its IUPAC name is 5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide
PubChem CID106267297
Molecular FormulaC12H16N2O2S2
Molecular Weight284.41 g/mol
Exact Mass284.07
IUPAC Name5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide
SMILESCC1CCCC(NS(=O)(=O)c2ccc(C#N)s2)C1
InChIInChI=1S/C12H16N2O2S2/c1-9-3-2-4-10(7-9)14-18(15,16)12-6-5-11(8-13)17-12/h5-6,9-10,14H,2-4,7H2,1H3
InChIKeyFAMDBZYJOWSAQE-UHFFFAOYSA-N
XLogP2.48
TPSA69.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-cyano-N-(3-methylcyclohexyl)thiophene-2-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

5-cyano-N-(4-methylsulfanylcyclohexyl)thiophene-2-sulfonamide
CID 106269739
5-cyano-N-(1,1-dioxothian-4-yl)thiophene-2-sulfonamide
CID 106267400
5-cyano-N-cyclohex-3-en-1-ylthiophene-2-sulfonamide
CID 106269472
5-cyano-N-(3,3,5,5-tetramethylcyclohexyl)thiophene-2-sulfonamide
CID 106268895
5-cyano-N-(4-propylcyclohexyl)thiophene-2-sulfonamide
CID 106267728
6-cyano-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
CID 115602590
5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide
CID 114178763
5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide
CID 114551883
5-cyano-N-(cyclopentylmethyl)thiophene-2-sulfonamide
CID 106267298
5-(4-methylazepan-1-yl)sulfonylthiophene-2-carbonitrile
CID 114166259
4-(aminomethyl)-N-(3-methylcyclohexyl)thiophene-2-sulfonamide
CID 114138567
5-cyano-N-[(2-hydroxycyclopentyl)methyl]thiophene-2-sulfonamide
CID 106268476

Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide?
The IUPAC name of 5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide (CID 106267297) is 5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide is CC1CCCC(NS(=O)(=O)c2ccc(C#N)s2)C1.
What is the InChIKey of 5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide?
The InChIKey is FAMDBZYJOWSAQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2S2/c1-9-3-2-4-10(7-9)14-18(15,16)12-6-5-11(8-13)17-12/h5-6,9-10,14H,2-4,7H2,1H3.
What are the key properties of 5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide?
5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide has a molecular weight of 284.41 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide is sourced from PubChem (CID 106267297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).