2-(4-nitrophenyl)-2-phenylpropanamide

C15H14N2O3 — CID 3046179

IUPAC2-(4-nitrophenyl)-2-phenylpropanamide
SMILESCC(C(N)=O)(c1ccccc1)c1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C15H14N2O3/c1-15(14(16)18,11-5-3-2-4-6-11)12-7-9-13(10-8-12)17(19)20/h2-10H,1H3,(H2,16,18)
InChIKeyJZCUTIIACJHTIS-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.39
Rot. Bonds4

About 2-(4-nitrophenyl)-2-phenylpropanamide

2-(4-nitrophenyl)-2-phenylpropanamide (PubChem CID 3046179) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is 2-(4-nitrophenyl)-2-phenylpropanamide.

Molecular Properties

Compound Name2-(4-nitrophenyl)-2-phenylpropanamide
PubChem CID3046179
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Name2-(4-nitrophenyl)-2-phenylpropanamide
SMILESCC(C(N)=O)(c1ccccc1)c1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C15H14N2O3/c1-15(14(16)18,11-5-3-2-4-6-11)12-7-9-13(10-8-12)17(19)20/h2-10H,1H3,(H2,16,18)
InChIKeyJZCUTIIACJHTIS-UHFFFAOYSA-N
XLogP2.39
TPSA86.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(4-nitrophenyl)-2-phenylpropanamide?
The IUPAC name of 2-(4-nitrophenyl)-2-phenylpropanamide (CID 3046179) is 2-(4-nitrophenyl)-2-phenylpropanamide.
What is the SMILES notation for 2-(4-nitrophenyl)-2-phenylpropanamide?
The canonical SMILES for 2-(4-nitrophenyl)-2-phenylpropanamide is CC(C(N)=O)(c1ccccc1)c1ccc([N+](=O)[O-])cc1.
What is the InChIKey of 2-(4-nitrophenyl)-2-phenylpropanamide?
The InChIKey is JZCUTIIACJHTIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-15(14(16)18,11-5-3-2-4-6-11)12-7-9-13(10-8-12)17(19)20/h2-10H,1H3,(H2,16,18).
What are the key properties of 2-(4-nitrophenyl)-2-phenylpropanamide?
2-(4-nitrophenyl)-2-phenylpropanamide has a molecular weight of 270.29 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-nitrophenyl)-2-phenylpropanamide is sourced from PubChem (CID 3046179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).