N-(4-ethylcyclohexyl)methanesulfonamide

C9H19NO2S — CID 22772399

IUPACN-(4-ethylcyclohexyl)methanesulfonamide
SMILESCCC1CCC(NS(C)(=O)=O)CC1
InChIInChI=1S/C9H19NO2S/c1-3-8-4-6-9(7-5-8)10-13(2,11)12/h8-10H,3-7H2,1-2H3
InChIKeyVSKQTKLVBFPZSZ-UHFFFAOYSA-N
MW205.32 g/mol
LogP1.50
Rot. Bonds3

About N-(4-ethylcyclohexyl)methanesulfonamide

N-(4-ethylcyclohexyl)methanesulfonamide (PubChem CID 22772399) has the molecular formula C9H19NO2S and a molecular weight of 205.32 g/mol. Its IUPAC name is N-(4-ethylcyclohexyl)methanesulfonamide.

Molecular Properties

Compound NameN-(4-ethylcyclohexyl)methanesulfonamide
PubChem CID22772399
Molecular FormulaC9H19NO2S
Molecular Weight205.32 g/mol
Exact Mass205.11
IUPAC NameN-(4-ethylcyclohexyl)methanesulfonamide
SMILESCCC1CCC(NS(C)(=O)=O)CC1
InChIInChI=1S/C9H19NO2S/c1-3-8-4-6-9(7-5-8)10-13(2,11)12/h8-10H,3-7H2,1-2H3
InChIKeyVSKQTKLVBFPZSZ-UHFFFAOYSA-N
XLogP1.50
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.32
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethylcyclohexyl)methanesulfonamide?
The IUPAC name of N-(4-ethylcyclohexyl)methanesulfonamide (CID 22772399) is N-(4-ethylcyclohexyl)methanesulfonamide.
What is the SMILES notation for N-(4-ethylcyclohexyl)methanesulfonamide?
The canonical SMILES for N-(4-ethylcyclohexyl)methanesulfonamide is CCC1CCC(NS(C)(=O)=O)CC1.
What is the InChIKey of N-(4-ethylcyclohexyl)methanesulfonamide?
The InChIKey is VSKQTKLVBFPZSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2S/c1-3-8-4-6-9(7-5-8)10-13(2,11)12/h8-10H,3-7H2,1-2H3.
What are the key properties of N-(4-ethylcyclohexyl)methanesulfonamide?
N-(4-ethylcyclohexyl)methanesulfonamide has a molecular weight of 205.32 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylcyclohexyl)methanesulfonamide is sourced from PubChem (CID 22772399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).