1-cyclohexyl-N-methylethanamine;ethane

C13H31N — CID 143356514

IUPAC1-cyclohexyl-N-methylethanamine;ethane
SMILESCC.CC.CNC(C)C1CCCCC1
InChIInChI=1S/C9H19N.2C2H6/c1-8(10-2)9-6-4-3-5-7-9;2*1-2/h8-10H,3-7H2,1-2H3;2*1-2H3
InChIKeyGKFFJAMDNBWHKF-UHFFFAOYSA-N
MW201.40 g/mol
LogP4.23
Rot. Bonds2

About 1-cyclohexyl-N-methylethanamine;ethane

1-cyclohexyl-N-methylethanamine;ethane (PubChem CID 143356514) has the molecular formula C13H31N and a molecular weight of 201.40 g/mol. Its IUPAC name is 1-cyclohexyl-N-methylethanamine;ethane.

Molecular Properties

Compound Name1-cyclohexyl-N-methylethanamine;ethane
PubChem CID143356514
Molecular FormulaC13H31N
Molecular Weight201.40 g/mol
Exact Mass201.25
IUPAC Name1-cyclohexyl-N-methylethanamine;ethane
SMILESCC.CC.CNC(C)C1CCCCC1
InChIInChI=1S/C9H19N.2C2H6/c1-8(10-2)9-6-4-3-5-7-9;2*1-2/h8-10H,3-7H2,1-2H3;2*1-2H3
InChIKeyGKFFJAMDNBWHKF-UHFFFAOYSA-N
XLogP4.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.40
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopentyl-N-methylethanamine;ethane
CID 142106515
1-cyclohexyl-N-methylethanamine;hydrochloride
CID 102555174
CID 162293667
CID 162293667
1-cyclopropyl-N-methylethanamine;hydrochloride
CID 24649766
1-cyclohexyl-N-(1-cyclopentylethyl)ethanamine
CID 62633016
N-[(1S)-1-cyclohexylethyl]propan-2-amine
CID 58682676
1-(4-fluorocyclohexyl)-N-methylethanamine
CID 84731477
[(1R)-1-cyclohexylethyl]hydrazine
CID 51585397
(1R)-N-methyl-1-(4-methylcyclohexyl)ethanamine
CID 94033456
N-[(1S)-1-cycloheptylethyl]cycloheptanamine
CID 81389840
N-(1-cyclopentylethyl)propan-2-amine
CID 59833137
N-methyl-1-(1-methylazepan-3-yl)ethanamine
CID 83905848

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-methylethanamine;ethane?
The IUPAC name of 1-cyclohexyl-N-methylethanamine;ethane (CID 143356514) is 1-cyclohexyl-N-methylethanamine;ethane.
What is the SMILES notation for 1-cyclohexyl-N-methylethanamine;ethane?
The canonical SMILES for 1-cyclohexyl-N-methylethanamine;ethane is CC.CC.CNC(C)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-methylethanamine;ethane?
The InChIKey is GKFFJAMDNBWHKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.2C2H6/c1-8(10-2)9-6-4-3-5-7-9;2*1-2/h8-10H,3-7H2,1-2H3;2*1-2H3.
What are the key properties of 1-cyclohexyl-N-methylethanamine;ethane?
1-cyclohexyl-N-methylethanamine;ethane has a molecular weight of 201.40 g/mol, XLogP of 4.23, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-methylethanamine;ethane is sourced from PubChem (CID 143356514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).