N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride

C13H25ClN2O — CID 120557474

IUPACN-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride
SMILESCC1CNCCC1NC(=O)C1CCCCC1.Cl
InChIInChI=1S/C13H24N2O.ClH/c1-10-9-14-8-7-12(10)15-13(16)11-5-3-2-4-6-11;/h10-12,14H,2-9H2,1H3,(H,15,16);1H
InChIKeyYCZOUEFFSVJNBO-UHFFFAOYSA-N
MW260.81 g/mol
LogP2.10
Rot. Bonds2

About N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride

N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride (PubChem CID 120557474) has the molecular formula C13H25ClN2O and a molecular weight of 260.81 g/mol. Its IUPAC name is N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride
PubChem CID120557474
Molecular FormulaC13H25ClN2O
Molecular Weight260.81 g/mol
Exact Mass260.17
IUPAC NameN-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride
SMILESCC1CNCCC1NC(=O)C1CCCCC1.Cl
InChIInChI=1S/C13H24N2O.ClH/c1-10-9-14-8-7-12(10)15-13(16)11-5-3-2-4-6-11;/h10-12,14H,2-9H2,1H3,(H,15,16);1H
InChIKeyYCZOUEFFSVJNBO-UHFFFAOYSA-N
XLogP2.10
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.81
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methylpiperidin-4-yl)oxane-4-carboxamide
CID 79886712
(3R)-N-(2-methylcycloheptyl)piperidine-3-carboxamide
CID 81134931
4-[(2-cyclopentylacetyl)amino]-N-(3-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 120555118
N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide
CID 120556652
N-(3-methylpiperidin-4-yl)-2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 120556975
N-pyrrolidin-3-ylcyclopentanecarboxamide;hydrochloride
CID 146675555
N-(3-methylpiperidin-4-yl)pyrrolidine-1-carboxamide
CID 79886370
2-(azepan-1-yl)-N-(3-methylpiperidin-4-yl)propanamide;dihydrochloride
CID 120557148
N-(2-methylcyclopropyl)pyrrolidine-3-carboxamide
CID 63006462
1-butanoyl-N-(3-methylpiperidin-4-yl)piperidine-2-carboxamide
CID 120555744
1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea
CID 79886101
1-(4-fluorophenyl)sulfonyl-N-(3-methylpiperidin-4-yl)piperidine-3-carboxamide;hydrochloride
CID 120556458

Frequently Asked Questions

What is the IUPAC name of N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride?
The IUPAC name of N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride (CID 120557474) is N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride.
What is the SMILES notation for N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride?
The canonical SMILES for N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride is CC1CNCCC1NC(=O)C1CCCCC1.Cl.
What is the InChIKey of N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride?
The InChIKey is YCZOUEFFSVJNBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O.ClH/c1-10-9-14-8-7-12(10)15-13(16)11-5-3-2-4-6-11;/h10-12,14H,2-9H2,1H3,(H,15,16);1H.
What are the key properties of N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride?
N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride has a molecular weight of 260.81 g/mol, XLogP of 2.10, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride is sourced from PubChem (CID 120557474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).