2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine

C11H24N2O2S — CID 79859494

IUPAC2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine
SMILESCN(CCS(C)(=O)=O)CC1CCCCC1N
InChIInChI=1S/C11H24N2O2S/c1-13(7-8-16(2,14)15)9-10-5-3-4-6-11(10)12/h10-11H,3-9,12H2,1-2H3
InChIKeyHBDSTAIEMLKFIS-UHFFFAOYSA-N
MW248.39 g/mol
LogP0.48
Rot. Bonds5

About 2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine

2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine (PubChem CID 79859494) has the molecular formula C11H24N2O2S and a molecular weight of 248.39 g/mol. Its IUPAC name is 2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine
PubChem CID79859494
Molecular FormulaC11H24N2O2S
Molecular Weight248.39 g/mol
Exact Mass248.16
IUPAC Name2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine
SMILESCN(CCS(C)(=O)=O)CC1CCCCC1N
InChIInChI=1S/C11H24N2O2S/c1-13(7-8-16(2,14)15)9-10-5-3-4-6-11(10)12/h10-11H,3-9,12H2,1-2H3
InChIKeyHBDSTAIEMLKFIS-UHFFFAOYSA-N
XLogP0.48
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclopentan-1-amine
CID 79858666
4-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine
CID 79858261
2,2-dimethyl-5-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclopentan-1-amine
CID 79855043
2-[[methyl(pentyl)amino]methyl]cyclohexan-1-amine
CID 62614941
2-[[butyl(methyl)amino]methyl]cyclopentan-1-amine
CID 62616937
2-(3-methylsulfonylpropyl)cyclohexan-1-amine
CID 63191344
2-[[methyl(pentyl)amino]methyl]cyclopentan-1-amine
CID 62615567
1-cyclohexyl-N'-methyl-N'-(2-methylsulfonylethyl)ethane-1,2-diamine
CID 104746719
N-(2,3,3a,4,5,6,7,7a-octahydro-1H-indol-2-ylmethyl)-N-methyl-2-methylsulfonylethanamine
CID 79863863
N,2,2-trimethyl-5-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclopentan-1-amine
CID 79856110
N-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-3-ylmethyl)-N-methyl-2-methylsulfonylethanamine
CID 102894643
N-methyl-2-[[methyl(2-methylsulfonylethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-amine
CID 79858757

Frequently Asked Questions

What is the IUPAC name of 2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine?
The IUPAC name of 2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine (CID 79859494) is 2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for 2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine?
The canonical SMILES for 2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine is CN(CCS(C)(=O)=O)CC1CCCCC1N.
What is the InChIKey of 2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine?
The InChIKey is HBDSTAIEMLKFIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2S/c1-13(7-8-16(2,14)15)9-10-5-3-4-6-11(10)12/h10-11H,3-9,12H2,1-2H3.
What are the key properties of 2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine?
2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine has a molecular weight of 248.39 g/mol, XLogP of 0.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[methyl(2-methylsulfonylethyl)amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 79859494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).