2-(4-nitrophenoxy)-N-phenylacetamide

C14H12N2O4 — CID 923397

IUPAC2-(4-nitrophenoxy)-N-phenylacetamide
SMILESO=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccc1
InChIInChI=1S/C14H12N2O4/c17-14(15-11-4-2-1-3-5-11)10-20-13-8-6-12(7-9-13)16(18)19/h1-9H,10H2,(H,15,17)
InChIKeyLEHIVXDDSQHROR-UHFFFAOYSA-N
MW272.26 g/mol
LogP2.61
Rot. Bonds5

About 2-(4-nitrophenoxy)-N-phenylacetamide

2-(4-nitrophenoxy)-N-phenylacetamide (PubChem CID 923397) has the molecular formula C14H12N2O4 and a molecular weight of 272.26 g/mol. Its IUPAC name is 2-(4-nitrophenoxy)-N-phenylacetamide.

Molecular Properties

Compound Name2-(4-nitrophenoxy)-N-phenylacetamide
PubChem CID923397
Molecular FormulaC14H12N2O4
Molecular Weight272.26 g/mol
Exact Mass272.08
IUPAC Name2-(4-nitrophenoxy)-N-phenylacetamide
SMILESO=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccc1
InChIInChI=1S/C14H12N2O4/c17-14(15-11-4-2-1-3-5-11)10-20-13-8-6-12(7-9-13)16(18)19/h1-9H,10H2,(H,15,17)
InChIKeyLEHIVXDDSQHROR-UHFFFAOYSA-N
XLogP2.61
TPSA81.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.26
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

2-(4-nitrophenoxy)-N-(4-nitrophenyl)acetamide
CID 4501442
N-(4-nitrophenyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 3114321
2-(4-nitrophenoxy)-N'-phenylacetohydrazide
CID 739659
N-[4-[[2-(4-nitrophenoxy)acetyl]amino]phenyl]propanamide
CID 17204846
4-[2-(4-nitroanilino)-2-oxoethoxy]-N-(4-nitrophenyl)benzamide
CID 10646566
N-(3-methylphenyl)-2-(4-nitrophenoxy)acetamide
CID 877748
N-(3-fluorophenyl)-2-(4-nitrophenoxy)acetamide
CID 802614
[2-(4-nitroanilino)-2-oxoethyl] 2-(4-phenylphenoxy)acetate
CID 9140711
N-benzyl-4-[[2-(4-nitrophenoxy)acetyl]amino]benzamide
CID 28639887
N-(4-anilinophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]benzamide
CID 4942017
N-[(4-nitrophenyl)carbamoyl]-2-[4-[2-[(4-nitrophenyl)carbamoylamino]-2-oxoethoxy]phenoxy]acetamide
CID 11981942
2-methyl-N-[4-[[2-(4-nitrophenoxy)acetyl]amino]phenyl]propanamide
CID 1295054

Frequently Asked Questions

What is the IUPAC name of 2-(4-nitrophenoxy)-N-phenylacetamide?
The IUPAC name of 2-(4-nitrophenoxy)-N-phenylacetamide (CID 923397) is 2-(4-nitrophenoxy)-N-phenylacetamide.
What is the SMILES notation for 2-(4-nitrophenoxy)-N-phenylacetamide?
The canonical SMILES for 2-(4-nitrophenoxy)-N-phenylacetamide is O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccc1.
What is the InChIKey of 2-(4-nitrophenoxy)-N-phenylacetamide?
The InChIKey is LEHIVXDDSQHROR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O4/c17-14(15-11-4-2-1-3-5-11)10-20-13-8-6-12(7-9-13)16(18)19/h1-9H,10H2,(H,15,17).
What are the key properties of 2-(4-nitrophenoxy)-N-phenylacetamide?
2-(4-nitrophenoxy)-N-phenylacetamide has a molecular weight of 272.26 g/mol, XLogP of 2.61, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-nitrophenoxy)-N-phenylacetamide is sourced from PubChem (CID 923397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).