N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide

C20H22N2O2 — CID 70004760

IUPACN-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NCc1ccc(N2CCCCC2=O)cc1
InChIInChI=1S/C20H22N2O2/c23-19(14-16-6-2-1-3-7-16)21-15-17-9-11-18(12-10-17)22-13-5-4-8-20(22)24/h1-3,6-7,9-12H,4-5,8,13-15H2,(H,21,23)
InChIKeyZYKRGASMZUKKPJ-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.06
Rot. Bonds5

About N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide

N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide (PubChem CID 70004760) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide
PubChem CID70004760
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC NameN-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NCc1ccc(N2CCCCC2=O)cc1
InChIInChI=1S/C20H22N2O2/c23-19(14-16-6-2-1-3-7-16)21-15-17-9-11-18(12-10-17)22-13-5-4-8-20(22)24/h1-3,6-7,9-12H,4-5,8,13-15H2,(H,21,23)
InChIKeyZYKRGASMZUKKPJ-UHFFFAOYSA-N
XLogP3.06
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-aminophenyl)-N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]acetamide;hydrochloride
CID 119749209
N-[(4-fluorophenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 9270495
N-[[4-(dimethylamino)phenyl]methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 9305669
2-chloro-N-[2-oxo-2-[[4-(2-oxopyrrolidin-1-yl)phenyl]methylamino]ethyl]benzamide
CID 8589010
N-(2,2-diphenylethyl)-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 26313258
N-[[4-(diethylaminomethyl)phenyl]methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 8948642
N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]butanamide
CID 24551216
4-(2-oxopyrrolidin-1-yl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide
CID 8589075
2-methylsulfanyl-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide
CID 8589226
2-(2-oxopyrrolidin-1-yl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide
CID 8589720
2-(1-hydroxycyclopentyl)-N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]acetamide
CID 111537212
3-(azocan-1-yl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]propanamide
CID 91797431

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide?
The IUPAC name of N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide (CID 70004760) is N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide.
What is the SMILES notation for N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide?
The canonical SMILES for N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide is O=C(Cc1ccccc1)NCc1ccc(N2CCCCC2=O)cc1.
What is the InChIKey of N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide?
The InChIKey is ZYKRGASMZUKKPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c23-19(14-16-6-2-1-3-7-16)21-15-17-9-11-18(12-10-17)22-13-5-4-8-20(22)24/h1-3,6-7,9-12H,4-5,8,13-15H2,(H,21,23).
What are the key properties of N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide?
N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide has a molecular weight of 322.41 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide is sourced from PubChem (CID 70004760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).