N-(4-ethoxycyclohexyl)methanesulfonamide

C9H19NO3S — CID 140745400

IUPACN-(4-ethoxycyclohexyl)methanesulfonamide
SMILESCCOC1CCC(NS(C)(=O)=O)CC1
InChIInChI=1S/C9H19NO3S/c1-3-13-9-6-4-8(5-7-9)10-14(2,11)12/h8-10H,3-7H2,1-2H3
InChIKeyKAEGWJTULUVVQM-UHFFFAOYSA-N
MW221.32 g/mol
LogP0.88
Rot. Bonds4

About N-(4-ethoxycyclohexyl)methanesulfonamide

N-(4-ethoxycyclohexyl)methanesulfonamide (PubChem CID 140745400) has the molecular formula C9H19NO3S and a molecular weight of 221.32 g/mol. Its IUPAC name is N-(4-ethoxycyclohexyl)methanesulfonamide.

Molecular Properties

Compound NameN-(4-ethoxycyclohexyl)methanesulfonamide
PubChem CID140745400
Molecular FormulaC9H19NO3S
Molecular Weight221.32 g/mol
Exact Mass221.11
IUPAC NameN-(4-ethoxycyclohexyl)methanesulfonamide
SMILESCCOC1CCC(NS(C)(=O)=O)CC1
InChIInChI=1S/C9H19NO3S/c1-3-13-9-6-4-8(5-7-9)10-14(2,11)12/h8-10H,3-7H2,1-2H3
InChIKeyKAEGWJTULUVVQM-UHFFFAOYSA-N
XLogP0.88
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.32
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxycyclohexyl)methanesulfonamide?
The IUPAC name of N-(4-ethoxycyclohexyl)methanesulfonamide (CID 140745400) is N-(4-ethoxycyclohexyl)methanesulfonamide.
What is the SMILES notation for N-(4-ethoxycyclohexyl)methanesulfonamide?
The canonical SMILES for N-(4-ethoxycyclohexyl)methanesulfonamide is CCOC1CCC(NS(C)(=O)=O)CC1.
What is the InChIKey of N-(4-ethoxycyclohexyl)methanesulfonamide?
The InChIKey is KAEGWJTULUVVQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO3S/c1-3-13-9-6-4-8(5-7-9)10-14(2,11)12/h8-10H,3-7H2,1-2H3.
What are the key properties of N-(4-ethoxycyclohexyl)methanesulfonamide?
N-(4-ethoxycyclohexyl)methanesulfonamide has a molecular weight of 221.32 g/mol, XLogP of 0.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxycyclohexyl)methanesulfonamide is sourced from PubChem (CID 140745400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).