N,N-dibenzylpiperidine-3-carboxamide;hydrochloride

C20H25ClN2O — CID 119261732

IUPACN,N-dibenzylpiperidine-3-carboxamide;hydrochloride
SMILESCl.O=C(C1CCCNC1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C20H24N2O.ClH/c23-20(19-12-7-13-21-14-19)22(15-17-8-3-1-4-9-17)16-18-10-5-2-6-11-18;/h1-6,8-11,19,21H,7,12-16H2;1H
InChIKeyGPXCROMIOZHYIB-UHFFFAOYSA-N
MW344.89 g/mol
LogP3.64
Rot. Bonds5

About N,N-dibenzylpiperidine-3-carboxamide;hydrochloride

N,N-dibenzylpiperidine-3-carboxamide;hydrochloride (PubChem CID 119261732) has the molecular formula C20H25ClN2O and a molecular weight of 344.89 g/mol. Its IUPAC name is N,N-dibenzylpiperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN,N-dibenzylpiperidine-3-carboxamide;hydrochloride
PubChem CID119261732
Molecular FormulaC20H25ClN2O
Molecular Weight344.89 g/mol
Exact Mass344.17
IUPAC NameN,N-dibenzylpiperidine-3-carboxamide;hydrochloride
SMILESCl.O=C(C1CCCNC1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C20H24N2O.ClH/c23-20(19-12-7-13-21-14-19)22(15-17-8-3-1-4-9-17)16-18-10-5-2-6-11-18;/h1-6,8-11,19,21H,7,12-16H2;1H
InChIKeyGPXCROMIOZHYIB-UHFFFAOYSA-N
XLogP3.64
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.89
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-oxoethyl)-N-benzylpiperidine-3-carboxamide
CID 119323255
(3S)-N-benzyl-N-propylpiperidine-3-carboxamide
CID 81123216
N-benzyl-N-propylpiperidine-3-carboxamide
CID 43588657
(3S)-N-benzyl-N-[2-(dimethylamino)ethyl]piperidine-3-carboxamide
CID 81126278
(3S)-N-(3-amino-3-oxopropyl)-N-benzylpiperidine-3-carboxamide
CID 81125382
N,N-dibenzylcyclohexanecarboxamide
CID 1371794
benzyl-[[(3R)-piperidin-3-yl]methyl]carbamic acid;hydrochloride
CID 67098710
N-benzyl-N-(cyanomethyl)pyrrolidine-3-carboxamide
CID 63005731
N-ethyl-N-(pyridin-4-ylmethyl)piperidine-3-carboxamide
CID 54873767
N-benzyl-N-(oxan-4-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119782435
N-[2-[benzyl(ethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;hydrochloride
CID 119304521
N-benzyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide
CID 63007100

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzylpiperidine-3-carboxamide;hydrochloride?
The IUPAC name of N,N-dibenzylpiperidine-3-carboxamide;hydrochloride (CID 119261732) is N,N-dibenzylpiperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N,N-dibenzylpiperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N,N-dibenzylpiperidine-3-carboxamide;hydrochloride is Cl.O=C(C1CCCNC1)N(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N,N-dibenzylpiperidine-3-carboxamide;hydrochloride?
The InChIKey is GPXCROMIOZHYIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O.ClH/c23-20(19-12-7-13-21-14-19)22(15-17-8-3-1-4-9-17)16-18-10-5-2-6-11-18;/h1-6,8-11,19,21H,7,12-16H2;1H.
What are the key properties of N,N-dibenzylpiperidine-3-carboxamide;hydrochloride?
N,N-dibenzylpiperidine-3-carboxamide;hydrochloride has a molecular weight of 344.89 g/mol, XLogP of 3.64, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzylpiperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119261732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).