2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide

C20H23NO2 — CID 11120437

IUPAC2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide
SMILESCC(C)(C)C(=O)NC(CC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H23NO2/c1-20(2,3)19(23)21-17(15-10-6-4-7-11-15)14-18(22)16-12-8-5-9-13-16/h4-13,17H,14H2,1-3H3,(H,21,23)
InChIKeySUOOLVNCJCEIJG-UHFFFAOYSA-N
MW309.41 g/mol
LogP4.16
Rot. Bonds5

About 2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide

2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide (PubChem CID 11120437) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is 2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide
PubChem CID11120437
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide
SMILESCC(C)(C)C(=O)NC(CC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H23NO2/c1-20(2,3)19(23)21-17(15-10-6-4-7-11-15)14-18(22)16-12-8-5-9-13-16/h4-13,17H,14H2,1-3H3,(H,21,23)
InChIKeySUOOLVNCJCEIJG-UHFFFAOYSA-N
XLogP4.16
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S)-1,2-diphenylethyl]-2,2-dimethylpropanamide
CID 41097241
2,2-dimethyl-N-(1-phenylethyl)propanamide
CID 4252554
methyl N-[1-(4-chlorophenyl)-3-oxo-3-phenylpropyl]carbamate
CID 102020553
N-(4-oxo-1,4-diphenylbutyl)acetamide
CID 13252857
3-(4-methylanilino)-1,3-diphenylpropan-1-one;hydrochloride
CID 2933530
1,3-diphenyl-3-(4-propan-2-ylanilino)propan-1-one
CID 154717560
N-[1-[(2-hydroxy-1-phenylethyl)amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide
CID 63182177
N-[1-(3-chlorophenyl)-3-oxo-3-phenylpropyl]acetamide
CID 86045214
3-benzamido-3-phenylpropanoic acid
CID 2834576
(3S)-3-benzamido-3-phenylpropanoic acid
CID 788098
N-[3-(4-nitrophenyl)-3-oxo-1-phenylpropyl]benzamide
CID 46933545
4-methyl-N-[(1R)-3-oxo-1,3-diphenylpropyl]piperazin-4-ium-1-carbothioamide
CID 7285000

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide?
The IUPAC name of 2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide (CID 11120437) is 2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide?
The canonical SMILES for 2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide is CC(C)(C)C(=O)NC(CC(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide?
The InChIKey is SUOOLVNCJCEIJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c1-20(2,3)19(23)21-17(15-10-6-4-7-11-15)14-18(22)16-12-8-5-9-13-16/h4-13,17H,14H2,1-3H3,(H,21,23).
What are the key properties of 2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide?
2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide has a molecular weight of 309.41 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(3-oxo-1,3-diphenylpropyl)propanamide is sourced from PubChem (CID 11120437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).