1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide

C11H22F2N2O2S — CID 71057852

IUPAC1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide
SMILESCN(CC(C)(F)F)S(=O)(=O)CC1(N)CCCCC1
InChIInChI=1S/C11H22F2N2O2S/c1-10(12,13)8-15(2)18(16,17)9-11(14)6-4-3-5-7-11/h3-9,14H2,1-2H3
InChIKeyFCRYIJIKHKGKFV-UHFFFAOYSA-N
MW284.37 g/mol
LogP1.56
Rot. Bonds5

About 1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide

1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide (PubChem CID 71057852) has the molecular formula C11H22F2N2O2S and a molecular weight of 284.37 g/mol. Its IUPAC name is 1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide.

Molecular Properties

Compound Name1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide
PubChem CID71057852
Molecular FormulaC11H22F2N2O2S
Molecular Weight284.37 g/mol
Exact Mass284.14
IUPAC Name1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide
SMILESCN(CC(C)(F)F)S(=O)(=O)CC1(N)CCCCC1
InChIInChI=1S/C11H22F2N2O2S/c1-10(12,13)8-15(2)18(16,17)9-11(14)6-4-3-5-7-11/h3-9,14H2,1-2H3
InChIKeyFCRYIJIKHKGKFV-UHFFFAOYSA-N
XLogP1.56
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide?
The IUPAC name of 1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide (CID 71057852) is 1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide.
What is the SMILES notation for 1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide?
The canonical SMILES for 1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide is CN(CC(C)(F)F)S(=O)(=O)CC1(N)CCCCC1.
What is the InChIKey of 1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide?
The InChIKey is FCRYIJIKHKGKFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22F2N2O2S/c1-10(12,13)8-15(2)18(16,17)9-11(14)6-4-3-5-7-11/h3-9,14H2,1-2H3.
What are the key properties of 1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide?
1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide has a molecular weight of 284.37 g/mol, XLogP of 1.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-aminocyclohexyl)-N-(2,2-difluoropropyl)-N-methylmethanesulfonamide is sourced from PubChem (CID 71057852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).