N-cycloheptylpiperidine-4-carboxamide;hydrochloride

C13H25ClN2O — CID 70702347

IUPACN-cycloheptylpiperidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCCCCC1)C1CCNCC1
InChIInChI=1S/C13H24N2O.ClH/c16-13(11-7-9-14-10-8-11)15-12-5-3-1-2-4-6-12;/h11-12,14H,1-10H2,(H,15,16);1H
InChIKeyZRRBCCMGLQXRAC-UHFFFAOYSA-N
MW260.81 g/mol
LogP2.25
Rot. Bonds2

About N-cycloheptylpiperidine-4-carboxamide;hydrochloride

N-cycloheptylpiperidine-4-carboxamide;hydrochloride (PubChem CID 70702347) has the molecular formula C13H25ClN2O and a molecular weight of 260.81 g/mol. Its IUPAC name is N-cycloheptylpiperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-cycloheptylpiperidine-4-carboxamide;hydrochloride
PubChem CID70702347
Molecular FormulaC13H25ClN2O
Molecular Weight260.81 g/mol
Exact Mass260.17
IUPAC NameN-cycloheptylpiperidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCCCCC1)C1CCNCC1
InChIInChI=1S/C13H24N2O.ClH/c16-13(11-7-9-14-10-8-11)15-12-5-3-1-2-4-6-12;/h11-12,14H,1-10H2,(H,15,16);1H
InChIKeyZRRBCCMGLQXRAC-UHFFFAOYSA-N
XLogP2.25
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 ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-piperidin-4-ylcycloheptanecarboxamide
CID 62587546
N-(azepan-4-yl)cyclohexanecarboxamide
CID 105059767
N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide
CID 171722600
N-piperidin-4-ylcyclopropanecarboxamide
CID 1445166
1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide
CID 2982201
N-cycloheptylcycloheptanecarboxamide
CID 129091005
N-cyclodecylcyclododecanecarboxamide
CID 135182352
N-cycloheptyl-N'-(piperidine-4-carbonyl)oxamide
CID 108530968
N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride
CID 172899475
N-(thian-4-yl)piperidine-4-carboxamide;hydrochloride
CID 119313224
4-(cyclopentanecarbonylamino)-N-piperidin-3-ylcyclohexane-1-carboxamide;hydrochloride
CID 119427846
N-pyrrolidin-3-ylcyclopentanecarboxamide;hydrochloride
CID 146675555

Frequently Asked Questions

What is the IUPAC name of N-cycloheptylpiperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-cycloheptylpiperidine-4-carboxamide;hydrochloride (CID 70702347) is N-cycloheptylpiperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-cycloheptylpiperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-cycloheptylpiperidine-4-carboxamide;hydrochloride is Cl.O=C(NC1CCCCCC1)C1CCNCC1.
What is the InChIKey of N-cycloheptylpiperidine-4-carboxamide;hydrochloride?
The InChIKey is ZRRBCCMGLQXRAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O.ClH/c16-13(11-7-9-14-10-8-11)15-12-5-3-1-2-4-6-12;/h11-12,14H,1-10H2,(H,15,16);1H.
What are the key properties of N-cycloheptylpiperidine-4-carboxamide;hydrochloride?
N-cycloheptylpiperidine-4-carboxamide;hydrochloride has a molecular weight of 260.81 g/mol, XLogP of 2.25, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptylpiperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 70702347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).