N,3-dimethylcyclohexan-1-amine;hydrochloride

C8H18ClN — CID 45286057

IUPACN,3-dimethylcyclohexan-1-amine;hydrochloride
SMILESCNC1CCCC(C)C1.Cl
InChIInChI=1S/C8H17N.ClH/c1-7-4-3-5-8(6-7)9-2;/h7-9H,3-6H2,1-2H3;1H
InChIKeyAIQOLFRXKSYEQY-UHFFFAOYSA-N
MW163.69 g/mol
LogP2.21
Rot. Bonds1

About N,3-dimethylcyclohexan-1-amine;hydrochloride

N,3-dimethylcyclohexan-1-amine;hydrochloride (PubChem CID 45286057) has the molecular formula C8H18ClN and a molecular weight of 163.69 g/mol. Its IUPAC name is N,3-dimethylcyclohexan-1-amine;hydrochloride.

Molecular Properties

Compound NameN,3-dimethylcyclohexan-1-amine;hydrochloride
PubChem CID45286057
Molecular FormulaC8H18ClN
Molecular Weight163.69 g/mol
Exact Mass163.11
IUPAC NameN,3-dimethylcyclohexan-1-amine;hydrochloride
SMILESCNC1CCCC(C)C1.Cl
InChIInChI=1S/C8H17N.ClH/c1-7-4-3-5-8(6-7)9-2;/h7-9H,3-6H2,1-2H3;1H
InChIKeyAIQOLFRXKSYEQY-UHFFFAOYSA-N
XLogP2.21
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.69
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,3-dimethylcyclohexan-1-amine;hydrochloride?
The IUPAC name of N,3-dimethylcyclohexan-1-amine;hydrochloride (CID 45286057) is N,3-dimethylcyclohexan-1-amine;hydrochloride.
What is the SMILES notation for N,3-dimethylcyclohexan-1-amine;hydrochloride?
The canonical SMILES for N,3-dimethylcyclohexan-1-amine;hydrochloride is CNC1CCCC(C)C1.Cl.
What is the InChIKey of N,3-dimethylcyclohexan-1-amine;hydrochloride?
The InChIKey is AIQOLFRXKSYEQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.ClH/c1-7-4-3-5-8(6-7)9-2;/h7-9H,3-6H2,1-2H3;1H.
What are the key properties of N,3-dimethylcyclohexan-1-amine;hydrochloride?
N,3-dimethylcyclohexan-1-amine;hydrochloride has a molecular weight of 163.69 g/mol, XLogP of 2.21, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethylcyclohexan-1-amine;hydrochloride is sourced from PubChem (CID 45286057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).