N-cyclohexylprop-2-ene-1-sulfonamide

C9H17NO2S — CID 78925210

IUPACN-cyclohexylprop-2-ene-1-sulfonamide
SMILESC=CCS(=O)(=O)NC1CCCCC1
InChIInChI=1S/C9H17NO2S/c1-2-8-13(11,12)10-9-6-4-3-5-7-9/h2,9-10H,1,3-8H2
InChIKeyWSMOVCJXEXXTMM-UHFFFAOYSA-N
MW203.31 g/mol
LogP1.42
Rot. Bonds4

About N-cyclohexylprop-2-ene-1-sulfonamide

N-cyclohexylprop-2-ene-1-sulfonamide (PubChem CID 78925210) has the molecular formula C9H17NO2S and a molecular weight of 203.31 g/mol. Its IUPAC name is N-cyclohexylprop-2-ene-1-sulfonamide.

Molecular Properties

Compound NameN-cyclohexylprop-2-ene-1-sulfonamide
PubChem CID78925210
Molecular FormulaC9H17NO2S
Molecular Weight203.31 g/mol
Exact Mass203.10
IUPAC NameN-cyclohexylprop-2-ene-1-sulfonamide
SMILESC=CCS(=O)(=O)NC1CCCCC1
InChIInChI=1S/C9H17NO2S/c1-2-8-13(11,12)10-9-6-4-3-5-7-9/h2,9-10H,1,3-8H2
InChIKeyWSMOVCJXEXXTMM-UHFFFAOYSA-N
XLogP1.42
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.31
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-chloro-N-cycloheptylmethanesulfonamide
CID 63666370
N-(2-amino-1-cyclopentylethyl)prop-2-ene-1-sulfonamide
CID 106737824
N-cyclohexyl-2,2-dimethylpropane-1-sulfonamide
CID 64591382
2-amino-N-cyclohexylethanesulfonamide chloride
CID 53347795
N-cyclohexylsulfamoyl iodide
CID 155625677
1-(azetidin-2-yl)-N-cyclohexylmethanesulfonamide
CID 115071232
1-(azetidin-3-yl)-N-cyclohexylmethanesulfonamide
CID 115039138
6-chloro-N-cyclohexylhexane-1-sulfonamide
CID 22111516
N-cycloheptylmethanesulfonamide
CID 3113423
cyclononylsulfamic acid
CID 67135870
N-cyclohexyl-2-ethoxyethanesulfonamide
CID 62732931
N-[1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrrolidin-3-yl]prop-2-ene-1-sulfonamide
CID 175807806

Frequently Asked Questions

What is the IUPAC name of N-cyclohexylprop-2-ene-1-sulfonamide?
The IUPAC name of N-cyclohexylprop-2-ene-1-sulfonamide (CID 78925210) is N-cyclohexylprop-2-ene-1-sulfonamide.
What is the SMILES notation for N-cyclohexylprop-2-ene-1-sulfonamide?
The canonical SMILES for N-cyclohexylprop-2-ene-1-sulfonamide is C=CCS(=O)(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexylprop-2-ene-1-sulfonamide?
The InChIKey is WSMOVCJXEXXTMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2S/c1-2-8-13(11,12)10-9-6-4-3-5-7-9/h2,9-10H,1,3-8H2.
What are the key properties of N-cyclohexylprop-2-ene-1-sulfonamide?
N-cyclohexylprop-2-ene-1-sulfonamide has a molecular weight of 203.31 g/mol, XLogP of 1.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylprop-2-ene-1-sulfonamide is sourced from PubChem (CID 78925210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).