[1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide

C10H18F3NO3S — CID 65006896

IUPAC[1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide
SMILESNS(=O)(=O)CC1(COCC(F)(F)F)CCCCC1
InChIInChI=1S/C10H18F3NO3S/c11-10(12,13)7-17-6-9(8-18(14,15)16)4-2-1-3-5-9/h1-8H2,(H2,14,15,16)
InChIKeyCVNOXMQCMZMIPW-UHFFFAOYSA-N
MW289.32 g/mol
LogP1.80
Rot. Bonds5

About [1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide

[1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide (PubChem CID 65006896) has the molecular formula C10H18F3NO3S and a molecular weight of 289.32 g/mol. Its IUPAC name is [1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide.

Molecular Properties

Compound Name[1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide
PubChem CID65006896
Molecular FormulaC10H18F3NO3S
Molecular Weight289.32 g/mol
Exact Mass289.10
IUPAC Name[1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide
SMILESNS(=O)(=O)CC1(COCC(F)(F)F)CCCCC1
InChIInChI=1S/C10H18F3NO3S/c11-10(12,13)7-17-6-9(8-18(14,15)16)4-2-1-3-5-9/h1-8H2,(H2,14,15,16)
InChIKeyCVNOXMQCMZMIPW-UHFFFAOYSA-N
XLogP1.80
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.32
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide 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

3-(2,2,2-Trifluoroethyl)-spiro[2-thiatetrahydro-2H-pyran-5,1'-cyclohexane]-2,2-dioxide
CID 132520133
1-(Cyclohexylmethoxy)-2,2,2-trifluoroethanesulfonamide
CID 67127821
[1-(2,2,2-Trifluoroethoxymethyl)cyclopentyl]methanesulfonamide
CID 65002950
2-Propyl-2-(2,2,2-trifluoroethoxymethyl)pentane-1-sulfonamide
CID 65005157
[1-(2,2,2-Trifluoroethoxymethyl)cyclohexyl]methanesulfonyl chloride
CID 65006648
[1-(2,2,2-Trifluoroethoxymethyl)cycloheptyl]methanesulfonamide
CID 65010290
[1-(1,1,1-Trifluoropropan-2-yloxymethyl)cycloheptyl]methanesulfonamide
CID 66274900
2-Propyl-2-(1,1,1-trifluoropropan-2-yloxymethyl)pentane-1-sulfonamide
CID 66274903
[1-(1,1,1-Trifluoropropan-2-yloxymethyl)cyclohexyl]methanesulfonamide
CID 66275110
[1-(1,1,1-Trifluoropropan-2-yloxymethyl)cyclohexyl]methanesulfonyl chloride
CID 66277495
[1-(2,2-Difluoroethoxymethyl)cyclohexyl]methanesulfonyl chloride
CID 82009444
[1-(2,2-Difluoroethoxymethyl)cycloheptyl]methanesulfonamide
CID 82009905

Frequently Asked Questions

What is the IUPAC name of [1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide?
The IUPAC name of [1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide (CID 65006896) is [1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide.
What is the SMILES notation for [1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide?
The canonical SMILES for [1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide is NS(=O)(=O)CC1(COCC(F)(F)F)CCCCC1.
What is the InChIKey of [1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide?
The InChIKey is CVNOXMQCMZMIPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO3S/c11-10(12,13)7-17-6-9(8-18(14,15)16)4-2-1-3-5-9/h1-8H2,(H2,14,15,16).
What are the key properties of [1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide?
[1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide has a molecular weight of 289.32 g/mol, XLogP of 1.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide is sourced from PubChem (CID 65006896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).