N-(4-methoxy-2-nitrophenyl)-2-phenylacetamide

C15H14N2O4 — CID 3101369

IUPACN-(4-methoxy-2-nitrophenyl)-2-phenylacetamide
SMILESCOc1ccc(NC(=O)Cc2ccccc2)c([N+](=O)[O-])c1
InChIInChI=1S/C15H14N2O4/c1-21-12-7-8-13(14(10-12)17(19)20)16-15(18)9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3,(H,16,18)
InChIKeyXCVYZHLSEUNZAY-UHFFFAOYSA-N
MW286.29 g/mol
LogP2.78
Rot. Bonds5

About N-(4-methoxy-2-nitrophenyl)-2-phenylacetamide

N-(4-methoxy-2-nitrophenyl)-2-phenylacetamide (PubChem CID 3101369) has the molecular formula C15H14N2O4 and a molecular weight of 286.29 g/mol. Its IUPAC name is N-(4-methoxy-2-nitrophenyl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(4-methoxy-2-nitrophenyl)-2-phenylacetamide
PubChem CID3101369
Molecular FormulaC15H14N2O4
Molecular Weight286.29 g/mol
Exact Mass286.10
IUPAC NameN-(4-methoxy-2-nitrophenyl)-2-phenylacetamide
SMILESCOc1ccc(NC(=O)Cc2ccccc2)c([N+](=O)[O-])c1
InChIInChI=1S/C15H14N2O4/c1-21-12-7-8-13(14(10-12)17(19)20)16-15(18)9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3,(H,16,18)
InChIKeyXCVYZHLSEUNZAY-UHFFFAOYSA-N
XLogP2.78
TPSA81.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 52.78
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

N-(4-methoxy-2-nitrophenyl)-2-naphthalen-2-ylacetamide
CID 16849665
N-(4-methoxy-2-nitrophenyl)-2-(2-methoxyphenyl)acetamide
CID 3375188
2-(4-benzylpiperazin-1-yl)-N-(4-methoxy-2-nitrophenyl)acetamide
CID 2978109
N-(4-methoxy-2-nitrophenyl)-3-phenylsulfanylpropanamide
CID 2975810
4-hydroxy-N-(4-methoxy-2-nitrophenyl)pentanamide
CID 79204847
N-(4-methoxy-2-nitrophenyl)-2-nitrosoacetamide
CID 90848222
2-[2-(4-methoxy-2-nitroanilino)-2-oxoethyl]sulfanylacetic acid
CID 115569447
3-[3-(4-methoxy-2-nitroanilino)-3-oxopropyl]sulfanyl-N-(4-methoxy-2-nitrophenyl)propanamide
CID 5142693
[2-(4-methoxy-2-nitroanilino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
CID 8671882
N-[2-[[2-(4-methoxy-2-nitroanilino)-2-oxoethyl]amino]phenyl]benzamide
CID 31983699
N,N'-bis(4-methoxy-2-nitrophenyl)-2-phenylpropanediamide
CID 3394012
3-ethoxy-N-(4-methoxy-2-nitrophenyl)propanamide
CID 2975661

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-2-nitrophenyl)-2-phenylacetamide?
The IUPAC name of N-(4-methoxy-2-nitrophenyl)-2-phenylacetamide (CID 3101369) is N-(4-methoxy-2-nitrophenyl)-2-phenylacetamide.
What is the SMILES notation for N-(4-methoxy-2-nitrophenyl)-2-phenylacetamide?
The canonical SMILES for N-(4-methoxy-2-nitrophenyl)-2-phenylacetamide is COc1ccc(NC(=O)Cc2ccccc2)c([N+](=O)[O-])c1.
What is the InChIKey of N-(4-methoxy-2-nitrophenyl)-2-phenylacetamide?
The InChIKey is XCVYZHLSEUNZAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4/c1-21-12-7-8-13(14(10-12)17(19)20)16-15(18)9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3,(H,16,18).
What are the key properties of N-(4-methoxy-2-nitrophenyl)-2-phenylacetamide?
N-(4-methoxy-2-nitrophenyl)-2-phenylacetamide has a molecular weight of 286.29 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-2-nitrophenyl)-2-phenylacetamide is sourced from PubChem (CID 3101369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).