2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride

C17H34ClN — CID 23617028

IUPAC2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride
SMILESCN(CCC1CCCCC1)CCC1CCCCC1.Cl
InChIInChI=1S/C17H33N.ClH/c1-18(14-12-16-8-4-2-5-9-16)15-13-17-10-6-3-7-11-17;/h16-17H,2-15H2,1H3;1H
InChIKeyAOGVZPKMWQFBMQ-UHFFFAOYSA-N
MW287.92 g/mol
LogP5.28
Rot. Bonds6

About 2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride

2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride (PubChem CID 23617028) has the molecular formula C17H34ClN and a molecular weight of 287.92 g/mol. Its IUPAC name is 2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride.

Molecular Properties

Compound Name2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride
PubChem CID23617028
Molecular FormulaC17H34ClN
Molecular Weight287.92 g/mol
Exact Mass287.24
IUPAC Name2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride
SMILESCN(CCC1CCCCC1)CCC1CCCCC1.Cl
InChIInChI=1S/C17H33N.ClH/c1-18(14-12-16-8-4-2-5-9-16)15-13-17-10-6-3-7-11-17;/h16-17H,2-15H2,1H3;1H
InChIKeyAOGVZPKMWQFBMQ-UHFFFAOYSA-N
XLogP5.28
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500287.92
LogP ≤ 55.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride?
The IUPAC name of 2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride (CID 23617028) is 2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride.
What is the SMILES notation for 2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride?
The canonical SMILES for 2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride is CN(CCC1CCCCC1)CCC1CCCCC1.Cl.
What is the InChIKey of 2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride?
The InChIKey is AOGVZPKMWQFBMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N.ClH/c1-18(14-12-16-8-4-2-5-9-16)15-13-17-10-6-3-7-11-17;/h16-17H,2-15H2,1H3;1H.
What are the key properties of 2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride?
2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride has a molecular weight of 287.92 g/mol, XLogP of 5.28, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-(2-cyclohexylethyl)-N-methylethanamine;hydrochloride is sourced from PubChem (CID 23617028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).