N-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide

C11H15NO2S2 — CID 154769115

IUPACN-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide
SMILESCN(c1ccsc1)S(=O)(=O)C1=CCCCC1
InChIInChI=1S/C11H15NO2S2/c1-12(10-7-8-15-9-10)16(13,14)11-5-3-2-4-6-11/h5,7-9H,2-4,6H2,1H3
InChIKeyTYZLPJLAQJBTRY-UHFFFAOYSA-N
MW257.38 g/mol
LogP2.97
Rot. Bonds3

About N-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide

N-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide (PubChem CID 154769115) has the molecular formula C11H15NO2S2 and a molecular weight of 257.38 g/mol. Its IUPAC name is N-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide.

Molecular Properties

Compound NameN-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide
PubChem CID154769115
Molecular FormulaC11H15NO2S2
Molecular Weight257.38 g/mol
Exact Mass257.05
IUPAC NameN-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide
SMILESCN(c1ccsc1)S(=O)(=O)C1=CCCCC1
InChIInChI=1S/C11H15NO2S2/c1-12(10-7-8-15-9-10)16(13,14)11-5-3-2-4-6-11/h5,7-9H,2-4,6H2,1H3
InChIKeyTYZLPJLAQJBTRY-UHFFFAOYSA-N
XLogP2.97
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide?
The IUPAC name of N-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide (CID 154769115) is N-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide.
What is the SMILES notation for N-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide?
The canonical SMILES for N-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide is CN(c1ccsc1)S(=O)(=O)C1=CCCCC1.
What is the InChIKey of N-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide?
The InChIKey is TYZLPJLAQJBTRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2S2/c1-12(10-7-8-15-9-10)16(13,14)11-5-3-2-4-6-11/h5,7-9H,2-4,6H2,1H3.
What are the key properties of N-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide?
N-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide has a molecular weight of 257.38 g/mol, XLogP of 2.97, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-thiophen-3-ylcyclohexene-1-sulfonamide is sourced from PubChem (CID 154769115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).