N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride

C12H18ClN3O — CID 56832240

IUPACN-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NCc1ccccn1)C1CCNCC1
InChIInChI=1S/C12H17N3O.ClH/c16-12(10-4-7-13-8-5-10)15-9-11-3-1-2-6-14-11;/h1-3,6,10,13H,4-5,7-9H2,(H,15,16);1H
InChIKeyKXOJRZOJKAIPRW-UHFFFAOYSA-N
MW255.75 g/mol
LogP1.12
Rot. Bonds3

About N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride

N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride (PubChem CID 56832240) has the molecular formula C12H18ClN3O and a molecular weight of 255.75 g/mol. Its IUPAC name is N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride
PubChem CID56832240
Molecular FormulaC12H18ClN3O
Molecular Weight255.75 g/mol
Exact Mass255.11
IUPAC NameN-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NCc1ccccn1)C1CCNCC1
InChIInChI=1S/C12H17N3O.ClH/c16-12(10-4-7-13-8-5-10)15-9-11-3-1-2-6-14-11;/h1-3,6,10,13H,4-5,7-9H2,(H,15,16);1H
InChIKeyKXOJRZOJKAIPRW-UHFFFAOYSA-N
XLogP1.12
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.75
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-N-cyclopropyl-1-N-(pyridin-2-ylmethyl)cyclohexane-1,4-dicarboxamide
CID 109144683
N-(3-pyridin-2-ylpropyl)azepane-4-carboxamide;dihydrochloride
CID 154910386
N-(3-pyridin-2-ylpropyl)azepane-4-carboxamide
CID 122565402
(1S)-N-(pyridin-2-ylmethyl)cyclohex-3-ene-1-carboxamide
CID 35511492
N-benzylpiperidine-4-carboxamide
CID 3868064
N-(pyridin-2-ylmethyl)azocane-2-carboxamide
CID 114240037
1-(1-cyclohexylpiperidin-4-yl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 26411415
1-N-cyclohexyl-4-N-(pyridin-2-ylmethyl)piperidine-1,4-dicarboxamide
CID 113004461
4-N-benzyl-4-N-methyl-1-N-(pyridin-2-ylmethyl)cyclohexane-1,4-dicarboxamide
CID 109148278
(5S)-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide
CID 100660418
(2R,3S)-3-(pyridin-2-ylmethylcarbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid
CID 40635560
cis-(1R,2S)-2-(pyridin-2-ylmethylcarbamoyl)cyclohexane-1-carboxylate
CID 6949299

Frequently Asked Questions

What is the IUPAC name of N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride (CID 56832240) is N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride is Cl.O=C(NCc1ccccn1)C1CCNCC1.
What is the InChIKey of N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride?
The InChIKey is KXOJRZOJKAIPRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O.ClH/c16-12(10-4-7-13-8-5-10)15-9-11-3-1-2-6-14-11;/h1-3,6,10,13H,4-5,7-9H2,(H,15,16);1H.
What are the key properties of N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride?
N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride has a molecular weight of 255.75 g/mol, XLogP of 1.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 56832240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).