2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine

C14H27NO3S — CID 104754135

IUPAC2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine
SMILESCCNC(CS(=O)(=O)C1CCCCC1)C1CCOC1
InChIInChI=1S/C14H27NO3S/c1-2-15-14(12-8-9-18-10-12)11-19(16,17)13-6-4-3-5-7-13/h12-15H,2-11H2,1H3
InChIKeyFEYKBFGRKFRDLG-UHFFFAOYSA-N
MW289.44 g/mol
LogP1.75
Rot. Bonds6

About 2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine

2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine (PubChem CID 104754135) has the molecular formula C14H27NO3S and a molecular weight of 289.44 g/mol. Its IUPAC name is 2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine.

Molecular Properties

Compound Name2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine
PubChem CID104754135
Molecular FormulaC14H27NO3S
Molecular Weight289.44 g/mol
Exact Mass289.17
IUPAC Name2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine
SMILESCCNC(CS(=O)(=O)C1CCCCC1)C1CCOC1
InChIInChI=1S/C14H27NO3S/c1-2-15-14(12-8-9-18-10-12)11-19(16,17)13-6-4-3-5-7-13/h12-15H,2-11H2,1H3
InChIKeyFEYKBFGRKFRDLG-UHFFFAOYSA-N
XLogP1.75
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.44
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine 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

2-cyclohexylsulfonyl-1-cyclopropyl-N-ethylethanamine
CID 64675598
2-(2,6-dichlorophenyl)sulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine
CID 104754077
N'-cyclopentyl-N-ethyl-N'-methyl-1-(oxolan-3-yl)ethane-1,2-diamine
CID 104744659
N-ethyl-1-(oxolan-3-yl)pentan-1-amine
CID 65330630
N-ethyl-2-[(2-methylphenyl)methylsulfonyl]-1-(oxolan-3-yl)ethanamine
CID 104754198
N'-cyclopentyl-N,N'-diethyl-1-(oxolan-3-yl)ethane-1,2-diamine
CID 113448037
2-(cyclopentylmethylsulfanyl)-N-ethyl-1-(oxolan-3-yl)ethanamine
CID 113449540
N'-(cyclopentylmethyl)-N-ethyl-N'-methyl-1-(oxolan-3-yl)ethane-1,2-diamine
CID 113448260
N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine
CID 65331868
N,N',N'-triethyl-1-(oxolan-3-yl)propane-1,3-diamine
CID 79087913
N-methyl-2-(2-methyloxolan-3-yl)sulfonyl-1-(oxolan-3-yl)ethanamine
CID 107758127
1-cyclopentyl-N-ethyl-2-methylsulfonylethanamine
CID 115601066

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine?
The IUPAC name of 2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine (CID 104754135) is 2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine.
What is the SMILES notation for 2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine?
The canonical SMILES for 2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine is CCNC(CS(=O)(=O)C1CCCCC1)C1CCOC1.
What is the InChIKey of 2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine?
The InChIKey is FEYKBFGRKFRDLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO3S/c1-2-15-14(12-8-9-18-10-12)11-19(16,17)13-6-4-3-5-7-13/h12-15H,2-11H2,1H3.
What are the key properties of 2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine?
2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine has a molecular weight of 289.44 g/mol, XLogP of 1.75, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylsulfonyl-N-ethyl-1-(oxolan-3-yl)ethanamine is sourced from PubChem (CID 104754135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).