N-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride

C13H27ClN2 — CID 119929256

IUPACN-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride
SMILESCN(CC1CCNCC1)C1CCCCC1.Cl
InChIInChI=1S/C13H26N2.ClH/c1-15(13-5-3-2-4-6-13)11-12-7-9-14-10-8-12;/h12-14H,2-11H2,1H3;1H
InChIKeyWAZKMWBEWZYQII-UHFFFAOYSA-N
MW246.83 g/mol
LogP2.67
Rot. Bonds3

About N-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride

N-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride (PubChem CID 119929256) has the molecular formula C13H27ClN2 and a molecular weight of 246.83 g/mol. Its IUPAC name is N-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride
PubChem CID119929256
Molecular FormulaC13H27ClN2
Molecular Weight246.83 g/mol
Exact Mass246.19
IUPAC NameN-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride
SMILESCN(CC1CCNCC1)C1CCCCC1.Cl
InChIInChI=1S/C13H26N2.ClH/c1-15(13-5-3-2-4-6-13)11-12-7-9-14-10-8-12;/h12-14H,2-11H2,1H3;1H
InChIKeyWAZKMWBEWZYQII-UHFFFAOYSA-N
XLogP2.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.83
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclohexylmethyl)-N-methylcyclohexanamine;ethane
CID 143467626
N-methyl-N-(piperidin-4-ylmethyl)azetidin-3-amine
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CID 62546416
N-methyl-1,1-dioxo-N-(piperidin-4-ylmethyl)thian-4-amine
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N-(cyclobutylmethyl)-N-methylazepan-3-amine
CID 62855304
N-methyl-N-(piperidin-4-ylmethyl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 79708298
N,N-dimethyl-1-piperidin-4-ylmethanamine;dihydrochloride
CID 23153381
N-[4-[methyl(piperidin-4-ylmethyl)amino]cyclohexyl]acetamide;hydrochloride
CID 120849563
N-methyl-N-[methyl(piperidin-4-ylmethyl)sulfamoyl]cyclohexanamine
CID 79716658
N-(piperidin-4-ylmethyl)-N-propan-2-ylcyclobutanamine;hydrochloride
CID 119932017
N-methyl-N-[(1-methylpiperidin-3-yl)methyl]piperidin-4-amine
CID 115118418
N-(cyclopropylmethyl)-N-methylcyclopropanamine
CID 67976432

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride?
The IUPAC name of N-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride (CID 119929256) is N-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride.
What is the SMILES notation for N-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride?
The canonical SMILES for N-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride is CN(CC1CCNCC1)C1CCCCC1.Cl.
What is the InChIKey of N-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride?
The InChIKey is WAZKMWBEWZYQII-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2.ClH/c1-15(13-5-3-2-4-6-13)11-12-7-9-14-10-8-12;/h12-14H,2-11H2,1H3;1H.
What are the key properties of N-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride?
N-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride has a molecular weight of 246.83 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(piperidin-4-ylmethyl)cyclohexanamine;hydrochloride is sourced from PubChem (CID 119929256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).