N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride

C13H25ClN2O — CID 119260134

IUPACN-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride
SMILESCl.O=C(NCC1CCCNC1)C1CCCCC1
InChIInChI=1S/C13H24N2O.ClH/c16-13(12-6-2-1-3-7-12)15-10-11-5-4-8-14-9-11;/h11-12,14H,1-10H2,(H,15,16);1H
InChIKeyUYHGGXMVKHYMEP-UHFFFAOYSA-N
MW260.81 g/mol
LogP2.10
Rot. Bonds3

About N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride

N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride (PubChem CID 119260134) has the molecular formula C13H25ClN2O and a molecular weight of 260.81 g/mol. Its IUPAC name is N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride.

Molecular Properties

Compound NameN-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride
PubChem CID119260134
Molecular FormulaC13H25ClN2O
Molecular Weight260.81 g/mol
Exact Mass260.17
IUPAC NameN-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride
SMILESCl.O=C(NCC1CCCNC1)C1CCCCC1
InChIInChI=1S/C13H24N2O.ClH/c16-13(12-6-2-1-3-7-12)15-10-11-5-4-8-14-9-11;/h11-12,14H,1-10H2,(H,15,16);1H
InChIKeyUYHGGXMVKHYMEP-UHFFFAOYSA-N
XLogP2.10
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
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-(piperidin-3-ylmethyl)cyclohexanecarboxamide
CID 18069614
N-[[(3R)-piperidin-3-yl]methyl]cycloheptanecarboxamide
CID 94502290
4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119463290
N-(cyclopentylmethyl)piperidine-3-carboxamide
CID 43371173
(3S)-N-(cyclopentylmethyl)piperidine-3-carboxamide
CID 81123262
2,2,3,3-tetramethyl-N-(piperidin-3-ylmethyl)cyclopropane-1-carboxamide
CID 66475790
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride
CID 119557894
N-(piperidin-3-ylmethyl)oxolane-3-carboxamide
CID 61271600
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide
CID 60894096
N-(2-pyrrolidin-3-ylethyl)cycloheptanecarboxamide;hydrochloride
CID 119537193
N-(piperidin-3-ylmethyl)azepane-1-carboxamide
CID 79152631
N-(3-cyclohexylpropyl)piperidine-3-carboxamide;hydrochloride
CID 119289858

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride?
The IUPAC name of N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride (CID 119260134) is N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride.
What is the SMILES notation for N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride?
The canonical SMILES for N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride is Cl.O=C(NCC1CCCNC1)C1CCCCC1.
What is the InChIKey of N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride?
The InChIKey is UYHGGXMVKHYMEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O.ClH/c16-13(12-6-2-1-3-7-12)15-10-11-5-4-8-14-9-11;/h11-12,14H,1-10H2,(H,15,16);1H.
What are the key properties of N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride?
N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride has a molecular weight of 260.81 g/mol, XLogP of 2.10, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride is sourced from PubChem (CID 119260134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).