N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide

C23H30N2O — CID 11163946

IUPACN-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide
SMILESCN(CCC1CCN(Cc2ccccc2)CC1)C(=O)Cc1ccccc1
InChIInChI=1S/C23H30N2O/c1-24(23(26)18-21-8-4-2-5-9-21)15-12-20-13-16-25(17-14-20)19-22-10-6-3-7-11-22/h2-11,20H,12-19H2,1H3
InChIKeyVQFSNGFBDHJEJS-UHFFFAOYSA-N
MW350.51 g/mol
LogP3.99
Rot. Bonds7

About N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide

N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide (PubChem CID 11163946) has the molecular formula C23H30N2O and a molecular weight of 350.51 g/mol. Its IUPAC name is N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide
PubChem CID11163946
Molecular FormulaC23H30N2O
Molecular Weight350.51 g/mol
Exact Mass350.24
IUPAC NameN-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide
SMILESCN(CCC1CCN(Cc2ccccc2)CC1)C(=O)Cc1ccccc1
InChIInChI=1S/C23H30N2O/c1-24(23(26)18-21-8-4-2-5-9-21)15-12-20-13-16-25(17-14-20)19-22-10-6-3-7-11-22/h2-11,20H,12-19H2,1H3
InChIKeyVQFSNGFBDHJEJS-UHFFFAOYSA-N
XLogP3.99
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.51
LogP ≤ 53.99
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-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide;hydrochloride
CID 14096792
N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-3-phenylprop-2-enamide
CID 56983782
N-benzyl-N-[2-(1-benzylpiperidin-4-yl)ethyl]benzamide
CID 14553502
N-methyl-2-phenyl-N-(2-piperidin-2-ylethyl)acetamide
CID 43187176
4-(1-benzylpiperidin-4-yl)-N,N-diethylbutan-1-amine;ethane
CID 142036971
N-(1-benzylpiperidin-4-yl)-N-methylcarbamoyl chloride
CID 82379735
3-(1-benzylazepan-4-yl)propanoic acid
CID 82624039
2-[4-[[4-[(dimethylamino)methyl]piperidin-1-yl]methyl]phenyl]acetic acid
CID 105345835
N-[2-(1-benzylpiperidin-4-yl)ethyl-ethylcarbamothioyl]benzamide
CID 10364177
1-benzyl-N-[[1-(2-hydroxypropyl)piperidin-4-yl]methyl]-N-methylpiperidine-4-carboxamide
CID 136512341
1-(1-benzylpiperidin-4-yl)ethanone
CID 910923

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide?
The IUPAC name of N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide (CID 11163946) is N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide.
What is the SMILES notation for N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide?
The canonical SMILES for N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide is CN(CCC1CCN(Cc2ccccc2)CC1)C(=O)Cc1ccccc1.
What is the InChIKey of N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide?
The InChIKey is VQFSNGFBDHJEJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O/c1-24(23(26)18-21-8-4-2-5-9-21)15-12-20-13-16-25(17-14-20)19-22-10-6-3-7-11-22/h2-11,20H,12-19H2,1H3.
What are the key properties of N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide?
N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide has a molecular weight of 350.51 g/mol, XLogP of 3.99, 7 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-methyl-2-phenylacetamide is sourced from PubChem (CID 11163946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).