N-cyclohexylpiperidine-4-carboxamide;hydrochloride

C12H23ClN2O — CID 44630870

IUPACN-cyclohexylpiperidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCCCC1)C1CCNCC1
InChIInChI=1S/C12H22N2O.ClH/c15-12(10-6-8-13-9-7-10)14-11-4-2-1-3-5-11;/h10-11,13H,1-9H2,(H,14,15);1H
InChIKeyNFEWOIKMJZYUTQ-UHFFFAOYSA-N
MW246.78 g/mol
LogP1.86
Rot. Bonds2

About N-cyclohexylpiperidine-4-carboxamide;hydrochloride

N-cyclohexylpiperidine-4-carboxamide;hydrochloride (PubChem CID 44630870) has the molecular formula C12H23ClN2O and a molecular weight of 246.78 g/mol. Its IUPAC name is N-cyclohexylpiperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-cyclohexylpiperidine-4-carboxamide;hydrochloride
PubChem CID44630870
Molecular FormulaC12H23ClN2O
Molecular Weight246.78 g/mol
Exact Mass246.15
IUPAC NameN-cyclohexylpiperidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCCCC1)C1CCNCC1
InChIInChI=1S/C12H22N2O.ClH/c15-12(10-6-8-13-9-7-10)14-11-4-2-1-3-5-11;/h10-11,13H,1-9H2,(H,14,15);1H
InChIKeyNFEWOIKMJZYUTQ-UHFFFAOYSA-N
XLogP1.86
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.78
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexylpiperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-cyclohexylpiperidine-4-carboxamide;hydrochloride (CID 44630870) is N-cyclohexylpiperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-cyclohexylpiperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-cyclohexylpiperidine-4-carboxamide;hydrochloride is Cl.O=C(NC1CCCCC1)C1CCNCC1.
What is the InChIKey of N-cyclohexylpiperidine-4-carboxamide;hydrochloride?
The InChIKey is NFEWOIKMJZYUTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O.ClH/c15-12(10-6-8-13-9-7-10)14-11-4-2-1-3-5-11;/h10-11,13H,1-9H2,(H,14,15);1H.
What are the key properties of N-cyclohexylpiperidine-4-carboxamide;hydrochloride?
N-cyclohexylpiperidine-4-carboxamide;hydrochloride has a molecular weight of 246.78 g/mol, XLogP of 1.86, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylpiperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 44630870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).