2-(3-aminophenyl)-N-phenylmethoxyacetamide

C15H16N2O2 — CID 65350168

IUPAC2-(3-aminophenyl)-N-phenylmethoxyacetamide
SMILESNc1cccc(CC(=O)NOCc2ccccc2)c1
InChIInChI=1S/C15H16N2O2/c16-14-8-4-7-13(9-14)10-15(18)17-19-11-12-5-2-1-3-6-12/h1-9H,10-11,16H2,(H,17,18)
InChIKeySLEOXONAPWWWSQ-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.06
Rot. Bonds5

About 2-(3-aminophenyl)-N-phenylmethoxyacetamide

2-(3-aminophenyl)-N-phenylmethoxyacetamide (PubChem CID 65350168) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 2-(3-aminophenyl)-N-phenylmethoxyacetamide.

Molecular Properties

Compound Name2-(3-aminophenyl)-N-phenylmethoxyacetamide
PubChem CID65350168
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name2-(3-aminophenyl)-N-phenylmethoxyacetamide
SMILESNc1cccc(CC(=O)NOCc2ccccc2)c1
InChIInChI=1S/C15H16N2O2/c16-14-8-4-7-13(9-14)10-15(18)17-19-11-12-5-2-1-3-6-12/h1-9H,10-11,16H2,(H,17,18)
InChIKeySLEOXONAPWWWSQ-UHFFFAOYSA-N
XLogP2.06
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(3,4-dichlorophenyl)-N-phenylmethoxyacetamide
CID 8908973
phenylmethoxymethyl 2-(3-aminophenyl)acetate
CID 102940348
2-(2-methylphenyl)-N-phenylmethoxyacetamide
CID 32578031
2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide
CID 63102778
2-(3-aminophenyl)-N-(cyclopropylmethyl)acetamide
CID 28689695
benzyl 3-aminobenzoate;methanol
CID 142867139
2-(3-aminophenyl)acetic acid;2-phenylacetamide
CID 157497347
1-(3-aminophenyl)-3-(3-hydroxyphenyl)propan-2-one
CID 116577080
2-(3-aminophenyl)acetic acid;propanoic acid
CID 175479045
(3R)-3-hydroxy-N-phenylmethoxybutanamide
CID 11106604
N-phenylmethoxy-2-phenylsulfanylacetamide
CID 47095881
2-(3-aminophenyl)-N-propylacetamide
CID 28689659

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminophenyl)-N-phenylmethoxyacetamide?
The IUPAC name of 2-(3-aminophenyl)-N-phenylmethoxyacetamide (CID 65350168) is 2-(3-aminophenyl)-N-phenylmethoxyacetamide.
What is the SMILES notation for 2-(3-aminophenyl)-N-phenylmethoxyacetamide?
The canonical SMILES for 2-(3-aminophenyl)-N-phenylmethoxyacetamide is Nc1cccc(CC(=O)NOCc2ccccc2)c1.
What is the InChIKey of 2-(3-aminophenyl)-N-phenylmethoxyacetamide?
The InChIKey is SLEOXONAPWWWSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c16-14-8-4-7-13(9-14)10-15(18)17-19-11-12-5-2-1-3-6-12/h1-9H,10-11,16H2,(H,17,18).
What are the key properties of 2-(3-aminophenyl)-N-phenylmethoxyacetamide?
2-(3-aminophenyl)-N-phenylmethoxyacetamide has a molecular weight of 256.31 g/mol, XLogP of 2.06, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminophenyl)-N-phenylmethoxyacetamide is sourced from PubChem (CID 65350168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).