4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine

C11H23NO2S — CID 60920149

IUPAC4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine
SMILESCCC1CCC(NCCS(C)(=O)=O)CC1
InChIInChI=1S/C11H23NO2S/c1-3-10-4-6-11(7-5-10)12-8-9-15(2,13)14/h10-12H,3-9H2,1-2H3
InChIKeyULRIMQNSJHIJHP-UHFFFAOYSA-N
MW233.38 g/mol
LogP1.59
Rot. Bonds5

About 4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine

4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine (PubChem CID 60920149) has the molecular formula C11H23NO2S and a molecular weight of 233.38 g/mol. Its IUPAC name is 4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine
PubChem CID60920149
Molecular FormulaC11H23NO2S
Molecular Weight233.38 g/mol
Exact Mass233.14
IUPAC Name4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine
SMILESCCC1CCC(NCCS(C)(=O)=O)CC1
InChIInChI=1S/C11H23NO2S/c1-3-10-4-6-11(7-5-10)12-8-9-15(2,13)14/h10-12H,3-9H2,1-2H3
InChIKeyULRIMQNSJHIJHP-UHFFFAOYSA-N
XLogP1.59
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.38
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylamino)-N-(4-ethylcyclohexyl)ethanesulfonamide
CID 106053036
4-tert-butyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine
CID 54932163
N-(2-methylsulfonylethyl)-1-propylpiperidin-4-amine
CID 60920378
CID 58917870
CID 58917870
1-N-(2-methylsulfonylethyl)cyclohexane-1,3-diamine
CID 79459348
N-(2-cyclopentylethyl)-4-ethylcyclohexan-1-amine
CID 63450135
N-decyl-4-ethylcyclohexan-1-amine
CID 63492402
2-(cyclopropylamino)-N-(4-propylcyclohexyl)ethanesulfonamide
CID 106054472
4-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclohexan-1-amine
CID 55192738
N-(2-propan-2-ylsulfonylethyl)-4-propylcyclohexan-1-amine
CID 106723458
1-(2-methylpropyl)-N-(2-methylsulfonylethyl)piperidin-4-amine
CID 103779495
4-methyl-N-(2-propylsulfonylethyl)cyclohexan-1-amine
CID 103830760

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine?
The IUPAC name of 4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine (CID 60920149) is 4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine?
The canonical SMILES for 4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine is CCC1CCC(NCCS(C)(=O)=O)CC1.
What is the InChIKey of 4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine?
The InChIKey is ULRIMQNSJHIJHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2S/c1-3-10-4-6-11(7-5-10)12-8-9-15(2,13)14/h10-12H,3-9H2,1-2H3.
What are the key properties of 4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine?
4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine has a molecular weight of 233.38 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(2-methylsulfonylethyl)cyclohexan-1-amine is sourced from PubChem (CID 60920149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).