N-benzhydryl-2-oxo-2-piperidin-1-ylacetamide

C20H22N2O2 — CID 108508001

IUPACN-benzhydryl-2-oxo-2-piperidin-1-ylacetamide
SMILESO=C(NC(c1ccccc1)c1ccccc1)C(=O)N1CCCCC1
InChIInChI=1S/C20H22N2O2/c23-19(20(24)22-14-8-3-9-15-22)21-18(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-2,4-7,10-13,18H,3,8-9,14-15H2,(H,21,23)
InChIKeyFBQOCZABEKQSQL-UHFFFAOYSA-N
MW322.41 g/mol
LogP2.90
Rot. Bonds3

About N-benzhydryl-2-oxo-2-piperidin-1-ylacetamide

N-benzhydryl-2-oxo-2-piperidin-1-ylacetamide (PubChem CID 108508001) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is N-benzhydryl-2-oxo-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-benzhydryl-2-oxo-2-piperidin-1-ylacetamide
PubChem CID108508001
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC NameN-benzhydryl-2-oxo-2-piperidin-1-ylacetamide
SMILESO=C(NC(c1ccccc1)c1ccccc1)C(=O)N1CCCCC1
InChIInChI=1S/C20H22N2O2/c23-19(20(24)22-14-8-3-9-15-22)21-18(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-2,4-7,10-13,18H,3,8-9,14-15H2,(H,21,23)
InChIKeyFBQOCZABEKQSQL-UHFFFAOYSA-N
XLogP2.90
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

2-oxo-N-(1-phenylethyl)-2-piperidin-1-ylacetamide
CID 108507850
1-[2-(benzhydrylamino)-2-oxoacetyl]piperidine-4-carboxamide
CID 45001400
N-benzhydryl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoacetamide
CID 108508045
(Z)-N-benzhydryl-2-cyano-3-piperidin-1-ylprop-2-enamide
CID 108840370
N-benzhydryl-4-[(1S)-1-piperidin-1-ylethyl]piperazine-1-carboxamide
CID 69018260
(2R)-2-hydroxy-2-phenyl-1-piperidin-1-ylethanone
CID 25233871
(2S)-2-hydroxy-2-phenyl-1-piperidin-1-ylethanone
CID 11257941
N-(1-phenylethyl)pyrrolidine-1-carboxamide
CID 108987850
N-(2-hydroxyphenyl)-2-oxo-2-piperidin-1-ylacetamide
CID 108514226
N-(2-hydroxy-1-phenylethyl)azepane-1-carboxamide
CID 112729485
N-(2,2,2-tribromo-1-phenylethyl)piperidine-1-carboxamide
CID 3673629
(2S)-2-amino-1-(azocan-1-yl)-2-phenylethanone
CID 28801220

Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-2-oxo-2-piperidin-1-ylacetamide?
The IUPAC name of N-benzhydryl-2-oxo-2-piperidin-1-ylacetamide (CID 108508001) is N-benzhydryl-2-oxo-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-benzhydryl-2-oxo-2-piperidin-1-ylacetamide?
The canonical SMILES for N-benzhydryl-2-oxo-2-piperidin-1-ylacetamide is O=C(NC(c1ccccc1)c1ccccc1)C(=O)N1CCCCC1.
What is the InChIKey of N-benzhydryl-2-oxo-2-piperidin-1-ylacetamide?
The InChIKey is FBQOCZABEKQSQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c23-19(20(24)22-14-8-3-9-15-22)21-18(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-2,4-7,10-13,18H,3,8-9,14-15H2,(H,21,23).
What are the key properties of N-benzhydryl-2-oxo-2-piperidin-1-ylacetamide?
N-benzhydryl-2-oxo-2-piperidin-1-ylacetamide has a molecular weight of 322.41 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-2-oxo-2-piperidin-1-ylacetamide is sourced from PubChem (CID 108508001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).