3,3-diphenyl-N-(trideuteriomethyl)propanamide

C16H17NO — CID 46782233

IUPAC3,3-diphenyl-N-(trideuteriomethyl)propanamide
SMILES[2H]C([2H])([2H])NC(=O)CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H17NO/c1-17-16(18)12-15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,15H,12H2,1H3,(H,17,18)/i1D3
InChIKeyDBUBYNLFHWVMRH-FIBGUPNXSA-N
MW242.34 g/mol
LogP2.95
Rot. Bonds5

About 3,3-diphenyl-N-(trideuteriomethyl)propanamide

3,3-diphenyl-N-(trideuteriomethyl)propanamide (PubChem CID 46782233) has the molecular formula C16H17NO and a molecular weight of 242.34 g/mol. Its IUPAC name is 3,3-diphenyl-N-(trideuteriomethyl)propanamide.

Molecular Properties

Compound Name3,3-diphenyl-N-(trideuteriomethyl)propanamide
PubChem CID46782233
Molecular FormulaC16H17NO
Molecular Weight242.34 g/mol
Exact Mass242.15
IUPAC Name3,3-diphenyl-N-(trideuteriomethyl)propanamide
SMILES[2H]C([2H])([2H])NC(=O)CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H17NO/c1-17-16(18)12-15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,15H,12H2,1H3,(H,17,18)/i1D3
InChIKeyDBUBYNLFHWVMRH-FIBGUPNXSA-N
XLogP2.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.34
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-3,3-diphenylpropanamide
CID 3373592
3,3-diphenyl-N-propylpropanamide
CID 4638647
2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide
CID 3469125
3,3-diphenyl-N-prop-2-ynylpropanamide
CID 30600997
N-(3,3-diphenylpropanoyl)benzamide
CID 101440172
N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide
CID 2268559
N-(2-methylbutan-2-yl)-3,3-diphenylpropanamide
CID 1292106
(3,3-diphenylpropanoylamino) propanoate
CID 174383570
N-[2-(dimethylamino)ethyl]-3,3-diphenylpropanamide
CID 2184828
N-(2-methoxyethyl)-3,3-diphenylpropanamide
CID 2263132
N-[(1S)-3-methyl-1-phenylbutyl]-3,3-diphenylpropanamide
CID 38003610
2-(3,3-diphenylpropanoylamino)propanediamide
CID 31062875

Frequently Asked Questions

What is the IUPAC name of 3,3-diphenyl-N-(trideuteriomethyl)propanamide?
The IUPAC name of 3,3-diphenyl-N-(trideuteriomethyl)propanamide (CID 46782233) is 3,3-diphenyl-N-(trideuteriomethyl)propanamide.
What is the SMILES notation for 3,3-diphenyl-N-(trideuteriomethyl)propanamide?
The canonical SMILES for 3,3-diphenyl-N-(trideuteriomethyl)propanamide is [2H]C([2H])([2H])NC(=O)CC(c1ccccc1)c1ccccc1.
What is the InChIKey of 3,3-diphenyl-N-(trideuteriomethyl)propanamide?
The InChIKey is DBUBYNLFHWVMRH-FIBGUPNXSA-N. The full InChI is InChI=1S/C16H17NO/c1-17-16(18)12-15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,15H,12H2,1H3,(H,17,18)/i1D3.
What are the key properties of 3,3-diphenyl-N-(trideuteriomethyl)propanamide?
3,3-diphenyl-N-(trideuteriomethyl)propanamide has a molecular weight of 242.34 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diphenyl-N-(trideuteriomethyl)propanamide is sourced from PubChem (CID 46782233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).