2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide

C17H17N3O3 — CID 3469125

IUPAC2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide
SMILESNC(=O)C(=O)NNC(=O)CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H17N3O3/c18-16(22)17(23)20-19-15(21)11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H,11H2,(H2,18,22)(H,19,21)(H,20,23)
InChIKeyKZAQRQNAQUBTLC-UHFFFAOYSA-N
MW311.34 g/mol
LogP0.84
Rot. Bonds4

About 2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide

2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide (PubChem CID 3469125) has the molecular formula C17H17N3O3 and a molecular weight of 311.34 g/mol. Its IUPAC name is 2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide.

Molecular Properties

Compound Name2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide
PubChem CID3469125
Molecular FormulaC17H17N3O3
Molecular Weight311.34 g/mol
Exact Mass311.13
IUPAC Name2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide
SMILESNC(=O)C(=O)NNC(=O)CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H17N3O3/c18-16(22)17(23)20-19-15(21)11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H,11H2,(H2,18,22)(H,19,21)(H,20,23)
InChIKeyKZAQRQNAQUBTLC-UHFFFAOYSA-N
XLogP0.84
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 50.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(3,3-diphenylpropanoylamino)propanediamide
CID 31062875
N-methyl-3,3-diphenylpropanamide
CID 3373592
3,3-diphenyl-N-(trideuteriomethyl)propanamide
CID 46782233
N'-(3,3-diphenylpropanoyl)-4-fluorobenzohydrazide
CID 4790819
N'-(3,3-diphenylpropanoyl)thiophene-2-carbohydrazide
CID 9479339
N-(4-hydroxyphenyl)-3,3-diphenylpropanamide
CID 836165
N-[(2R)-1-methoxypropan-2-yl]-3,3-diphenylpropanamide
CID 7299747
N-(3,3-diphenylpropanoyl)benzamide
CID 101440172
N-methoxy-3-(4-methoxyphenyl)-3-phenylpropanamide
CID 144913522
N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide
CID 2268559
N-(2-aminophenyl)-3,3-diphenylpropanamide
CID 28866940
(3,3-diphenylpropanoylamino) propanoate
CID 174383570

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide?
The IUPAC name of 2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide (CID 3469125) is 2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide.
What is the SMILES notation for 2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide?
The canonical SMILES for 2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide is NC(=O)C(=O)NNC(=O)CC(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide?
The InChIKey is KZAQRQNAQUBTLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O3/c18-16(22)17(23)20-19-15(21)11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H,11H2,(H2,18,22)(H,19,21)(H,20,23).
What are the key properties of 2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide?
2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide has a molecular weight of 311.34 g/mol, XLogP of 0.84, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3,3-diphenylpropanoyl)hydrazinyl]-2-oxoacetamide is sourced from PubChem (CID 3469125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).