(1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine

C11H23NO2S — CID 81384341

IUPAC(1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine
SMILESC[C@@H](NCCS(C)(=O)=O)C1CCCCC1
InChIInChI=1S/C11H23NO2S/c1-10(11-6-4-3-5-7-11)12-8-9-15(2,13)14/h10-12H,3-9H2,1-2H3/t10-/m1/s1
InChIKeyBQXKBYYMHKLOFU-SNVBAGLBSA-N
MW233.38 g/mol
LogP1.59
Rot. Bonds5

About (1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine

(1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine (PubChem CID 81384341) has the molecular formula C11H23NO2S and a molecular weight of 233.38 g/mol. Its IUPAC name is (1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine.

Molecular Properties

Compound Name(1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine
PubChem CID81384341
Molecular FormulaC11H23NO2S
Molecular Weight233.38 g/mol
Exact Mass233.14
IUPAC Name(1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine
SMILESC[C@@H](NCCS(C)(=O)=O)C1CCCCC1
InChIInChI=1S/C11H23NO2S/c1-10(11-6-4-3-5-7-11)12-8-9-15(2,13)14/h10-12H,3-9H2,1-2H3/t10-/m1/s1
InChIKeyBQXKBYYMHKLOFU-SNVBAGLBSA-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

(1S)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine
CID 81385111
N-[(1S)-1-cyclopentylethyl]-3-methylsulfonylpropan-1-amine
CID 81395595
(1R)-1-cyclopentyl-N-(2-ethylsulfonylethyl)ethanamine
CID 81394699
N-[(1R)-1-cycloheptylethyl]propan-1-amine
CID 81393503
N-(2-methylsulfonylethyl)propan-2-amine
CID 60708370
(1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine
CID 81384500
N-(1-cyclopentylethyl)propan-1-amine
CID 60819417
N-[(1R)-1-cyclopentylethyl]propan-1-amine
CID 81395735
ethane;N-(2-methylsulfonylethyl)propan-2-amine
CID 142531419
N-(2-chloroethyl)-1-cyclohexylethanamine;hydrochloride
CID 173240168
(2S)-N-[(1R)-1-cyclohexylethyl]-2-methylbutan-1-amine
CID 94431803
N-(2-tert-butylsulfonylethyl)-1-cyclopropylethanamine
CID 115677017

Frequently Asked Questions

What is the IUPAC name of (1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine?
The IUPAC name of (1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine (CID 81384341) is (1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine.
What is the SMILES notation for (1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine?
The canonical SMILES for (1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine is C[C@@H](NCCS(C)(=O)=O)C1CCCCC1.
What is the InChIKey of (1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine?
The InChIKey is BQXKBYYMHKLOFU-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H23NO2S/c1-10(11-6-4-3-5-7-11)12-8-9-15(2,13)14/h10-12H,3-9H2,1-2H3/t10-/m1/s1.
What are the key properties of (1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine?
(1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine 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 (1R)-1-cyclohexyl-N-(2-methylsulfonylethyl)ethanamine is sourced from PubChem (CID 81384341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).