2-oxo-3,3,3-triphenylpropanamide

C21H17NO2 — CID 174934653

IUPAC2-oxo-3,3,3-triphenylpropanamide
SMILESNC(=O)C(=O)C(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H17NO2/c22-20(24)19(23)21(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H,(H2,22,24)
InChIKeyFYDNCBCKIIUYIF-UHFFFAOYSA-N
MW315.37 g/mol
LogP3.08
Rot. Bonds5

About 2-oxo-3,3,3-triphenylpropanamide

2-oxo-3,3,3-triphenylpropanamide (PubChem CID 174934653) has the molecular formula C21H17NO2 and a molecular weight of 315.37 g/mol. Its IUPAC name is 2-oxo-3,3,3-triphenylpropanamide.

Molecular Properties

Compound Name2-oxo-3,3,3-triphenylpropanamide
PubChem CID174934653
Molecular FormulaC21H17NO2
Molecular Weight315.37 g/mol
Exact Mass315.13
IUPAC Name2-oxo-3,3,3-triphenylpropanamide
SMILESNC(=O)C(=O)C(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H17NO2/c22-20(24)19(23)21(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H,(H2,22,24)
InChIKeyFYDNCBCKIIUYIF-UHFFFAOYSA-N
XLogP3.08
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2,2,2-triphenylacetyl) 2,2,2-triphenylacetate
CID 22605235
2,2-diphenylbut-3-ynamide
CID 102000055
2-amino-2-hydroxy-2-phenylacetamide
CID 149436781
N-methoxy-2,2,2-triphenylacetamide
CID 175153772
3,3-diphenylpentanediamide
CID 141227643
2-(4-methylphenyl)-2,2-diphenylacetic acid
CID 19733760
1,1-diphenylethyl carbamate
CID 20976713
oxamide;phenol
CID 21277500
2-(1,1-diphenylethyl)propanediamide
CID 175584560
4-[hydroxy(diphenyl)methyl]benzamide
CID 125464922
[dichloro(phenyl)methyl] carbamate
CID 66779545
tert-butyl 2,2,2-triphenylacetate;hydrogen peroxide
CID 174664507

Frequently Asked Questions

What is the IUPAC name of 2-oxo-3,3,3-triphenylpropanamide?
The IUPAC name of 2-oxo-3,3,3-triphenylpropanamide (CID 174934653) is 2-oxo-3,3,3-triphenylpropanamide.
What is the SMILES notation for 2-oxo-3,3,3-triphenylpropanamide?
The canonical SMILES for 2-oxo-3,3,3-triphenylpropanamide is NC(=O)C(=O)C(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-oxo-3,3,3-triphenylpropanamide?
The InChIKey is FYDNCBCKIIUYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17NO2/c22-20(24)19(23)21(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H,(H2,22,24).
What are the key properties of 2-oxo-3,3,3-triphenylpropanamide?
2-oxo-3,3,3-triphenylpropanamide has a molecular weight of 315.37 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-3,3,3-triphenylpropanamide is sourced from PubChem (CID 174934653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).