N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride

C22H29ClN2O — CID 14096792

IUPACN-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride
SMILESCN(CCC1CCN(Cc2ccccc2)CC1)C(=O)c1ccccc1.Cl
InChIInChI=1S/C22H28N2O.ClH/c1-23(22(25)21-10-6-3-7-11-21)15-12-19-13-16-24(17-14-19)18-20-8-4-2-5-9-20;/h2-11,19H,12-18H2,1H3;1H
InChIKeyHVJQLZBXJDYKBG-UHFFFAOYSA-N
MW372.94 g/mol
LogP4.48
Rot. Bonds6

About N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride

N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride (PubChem CID 14096792) has the molecular formula C22H29ClN2O and a molecular weight of 372.94 g/mol. Its IUPAC name is N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride
PubChem CID14096792
Molecular FormulaC22H29ClN2O
Molecular Weight372.94 g/mol
Exact Mass372.20
IUPAC NameN-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride
SMILESCN(CCC1CCN(Cc2ccccc2)CC1)C(=O)c1ccccc1.Cl
InChIInChI=1S/C22H28N2O.ClH/c1-23(22(25)21-10-6-3-7-11-21)15-12-19-13-16-24(17-14-19)18-20-8-4-2-5-9-20;/h2-11,19H,12-18H2,1H3;1H
InChIKeyHVJQLZBXJDYKBG-UHFFFAOYSA-N
XLogP4.48
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.94
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide
CID 10019926
N-benzyl-N-[2-(1-benzylpiperidin-4-yl)ethyl]benzamide
CID 14553502
N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide
CID 11163946
N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-3-phenylprop-2-enamide
CID 56983782
N-[2-(1-benzylpiperidin-4-yl)ethyl-ethylcarbamothioyl]benzamide
CID 10364177
N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-phenylpyridine-3-carboxamide
CID 23223142
4-(1-benzylpiperidin-4-yl)-N,N-diethylbutan-1-amine;ethane
CID 142036971
N-[(1-benzylpiperidin-4-yl)methyl]-1-ethyl-N-methyl-2-oxopyridine-4-carboxamide
CID 70716067
N-methyl-N-[2-[(2S)-oxan-2-yl]ethyl]-4-(piperidin-1-ylmethyl)benzamide
CID 97201362
2-(1-benzylpiperidin-4-yl)ethanamine;dihydrochloride
CID 17221509
N-(1-benzylpiperidin-4-yl)-N-methylcarbamoyl chloride
CID 82379735
2-amino-N-[(1-benzylpyrrolidin-3-yl)methyl]-N,2-dimethylpropanamide;dihydrochloride
CID 119884933

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride?
The IUPAC name of N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride (CID 14096792) is N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride.
What is the SMILES notation for N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride?
The canonical SMILES for N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride is CN(CCC1CCN(Cc2ccccc2)CC1)C(=O)c1ccccc1.Cl.
What is the InChIKey of N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride?
The InChIKey is HVJQLZBXJDYKBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O.ClH/c1-23(22(25)21-10-6-3-7-11-21)15-12-19-13-16-24(17-14-19)18-20-8-4-2-5-9-20;/h2-11,19H,12-18H2,1H3;1H.
What are the key properties of N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride?
N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride has a molecular weight of 372.94 g/mol, XLogP of 4.48, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride is sourced from PubChem (CID 14096792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).