N-(2-nitrophenyl)-2-phenylacetamide

C14H12N2O3 — CID 3141102

IUPACN-(2-nitrophenyl)-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1ccccc1[N+](=O)[O-]
InChIInChI=1S/C14H12N2O3/c17-14(10-11-6-2-1-3-7-11)15-12-8-4-5-9-13(12)16(18)19/h1-9H,10H2,(H,15,17)
InChIKeyDRHZHHXNOKNSMS-UHFFFAOYSA-N
MW256.26 g/mol
LogP2.78
Rot. Bonds4

About N-(2-nitrophenyl)-2-phenylacetamide

N-(2-nitrophenyl)-2-phenylacetamide (PubChem CID 3141102) has the molecular formula C14H12N2O3 and a molecular weight of 256.26 g/mol. Its IUPAC name is N-(2-nitrophenyl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(2-nitrophenyl)-2-phenylacetamide
PubChem CID3141102
Molecular FormulaC14H12N2O3
Molecular Weight256.26 g/mol
Exact Mass256.08
IUPAC NameN-(2-nitrophenyl)-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1ccccc1[N+](=O)[O-]
InChIInChI=1S/C14H12N2O3/c17-14(10-11-6-2-1-3-7-11)15-12-8-4-5-9-13(12)16(18)19/h1-9H,10H2,(H,15,17)
InChIKeyDRHZHHXNOKNSMS-UHFFFAOYSA-N
XLogP2.78
TPSA72.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 52.78
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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Related Compounds

Benzamide, N-(3-nitrophenyl)-
CID 78503
N-(2-aminophenyl)benzamide
CID 759408
4'-Nitrobenzanilide
CID 76930
Benzeneacetamide, N-(3-nitrophenyl)-
CID 531991
4'-Nitro-p-toluanilide
CID 99257
2-[(4-fluorobenzyl)amino]-N-(2-nitrophenyl)acetamide
CID 4187904
4-Nitro-N-(2-((4-nitrobenzoyl)amino)phenyl)benzamide
CID 3570851
N-(2-(Benzoylamino)-4-nitrophenyl)benzamide
CID 3655259
N,2-Diphenylacetamide
CID 225533
4'-Fluoro-3-nitrobenzanilide
CID 765293
2'-Nitrobenzanilide
CID 69769
3-Hydroxy-2-phenylquinoxalin-1-ium-1-olate
CID 736441

Frequently Asked Questions

What is the IUPAC name of N-(2-nitrophenyl)-2-phenylacetamide?
The IUPAC name of N-(2-nitrophenyl)-2-phenylacetamide (CID 3141102) is N-(2-nitrophenyl)-2-phenylacetamide.
What is the SMILES notation for N-(2-nitrophenyl)-2-phenylacetamide?
The canonical SMILES for N-(2-nitrophenyl)-2-phenylacetamide is O=C(Cc1ccccc1)Nc1ccccc1[N+](=O)[O-].
What is the InChIKey of N-(2-nitrophenyl)-2-phenylacetamide?
The InChIKey is DRHZHHXNOKNSMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O3/c17-14(10-11-6-2-1-3-7-11)15-12-8-4-5-9-13(12)16(18)19/h1-9H,10H2,(H,15,17).
What are the key properties of N-(2-nitrophenyl)-2-phenylacetamide?
N-(2-nitrophenyl)-2-phenylacetamide has a molecular weight of 256.26 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-nitrophenyl)-2-phenylacetamide is sourced from PubChem (CID 3141102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).