2-cyclohexyl-N-methylethanamine;hydrochloride

C9H20ClN — CID 3028086

IUPAC2-cyclohexyl-N-methylethanamine;hydrochloride
SMILESCNCCC1CCCCC1.Cl
InChIInChI=1S/C9H19N.ClH/c1-10-8-7-9-5-3-2-4-6-9;/h9-10H,2-8H2,1H3;1H
InChIKeyVZHXJJIXJKTLKV-UHFFFAOYSA-N
MW177.72 g/mol
LogP2.60
Rot. Bonds3

About 2-cyclohexyl-N-methylethanamine;hydrochloride

2-cyclohexyl-N-methylethanamine;hydrochloride (PubChem CID 3028086) has the molecular formula C9H20ClN and a molecular weight of 177.72 g/mol. Its IUPAC name is 2-cyclohexyl-N-methylethanamine;hydrochloride.

Molecular Properties

Compound Name2-cyclohexyl-N-methylethanamine;hydrochloride
PubChem CID3028086
Molecular FormulaC9H20ClN
Molecular Weight177.72 g/mol
Exact Mass177.13
IUPAC Name2-cyclohexyl-N-methylethanamine;hydrochloride
SMILESCNCCC1CCCCC1.Cl
InChIInChI=1S/C9H19N.ClH/c1-10-8-7-9-5-3-2-4-6-9;/h9-10H,2-8H2,1H3;1H
InChIKeyVZHXJJIXJKTLKV-UHFFFAOYSA-N
XLogP2.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.72
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-methylethanamine;hydrochloride?
The IUPAC name of 2-cyclohexyl-N-methylethanamine;hydrochloride (CID 3028086) is 2-cyclohexyl-N-methylethanamine;hydrochloride.
What is the SMILES notation for 2-cyclohexyl-N-methylethanamine;hydrochloride?
The canonical SMILES for 2-cyclohexyl-N-methylethanamine;hydrochloride is CNCCC1CCCCC1.Cl.
What is the InChIKey of 2-cyclohexyl-N-methylethanamine;hydrochloride?
The InChIKey is VZHXJJIXJKTLKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.ClH/c1-10-8-7-9-5-3-2-4-6-9;/h9-10H,2-8H2,1H3;1H.
What are the key properties of 2-cyclohexyl-N-methylethanamine;hydrochloride?
2-cyclohexyl-N-methylethanamine;hydrochloride has a molecular weight of 177.72 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-methylethanamine;hydrochloride is sourced from PubChem (CID 3028086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).