2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide

C16H18N2O2 — CID 28711930

IUPAC2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide
SMILESCOc1ccccc1CNC(=O)Cc1cccc(N)c1
InChIInChI=1S/C16H18N2O2/c1-20-15-8-3-2-6-13(15)11-18-16(19)10-12-5-4-7-14(17)9-12/h2-9H,10-11,17H2,1H3,(H,18,19)
InChIKeyPZWDWOQDYDYVKR-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.14
Rot. Bonds5

About 2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide

2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide (PubChem CID 28711930) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide
PubChem CID28711930
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide
SMILESCOc1ccccc1CNC(=O)Cc1cccc(N)c1
InChIInChI=1S/C16H18N2O2/c1-20-15-8-3-2-6-13(15)11-18-16(19)10-12-5-4-7-14(17)9-12/h2-9H,10-11,17H2,1H3,(H,18,19)
InChIKeyPZWDWOQDYDYVKR-UHFFFAOYSA-N
XLogP2.14
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(3-aminophenyl)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 28711954
N-[(2-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 2713308
2-(3-chloro-4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 110767041
N-[(2-methoxyphenyl)methyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 18189509
2-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 808183
N-[(4-amino-2-methoxyphenyl)methyl]-2-(4-aminophenyl)acetamide
CID 143586578
(E)-3-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]prop-2-enamide
CID 115342604
2-(5-amino-2-pyridinyl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 107337362
N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-(2-methoxyphenyl)acetamide
CID 110780829
N-[(3-aminophenyl)methyl]-2-(3,4-dimethylphenyl)acetamide
CID 62553117
2-(2-amino-4,5-dimethoxyphenyl)-N-benzylacetamide
CID 154144310
N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(2-methoxyphenyl)acetamide
CID 110780208

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide?
The IUPAC name of 2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide (CID 28711930) is 2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide is COc1ccccc1CNC(=O)Cc1cccc(N)c1.
What is the InChIKey of 2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide?
The InChIKey is PZWDWOQDYDYVKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-20-15-8-3-2-6-13(15)11-18-16(19)10-12-5-4-7-14(17)9-12/h2-9H,10-11,17H2,1H3,(H,18,19).
What are the key properties of 2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide?
2-(3-aminophenyl)-N-[(2-methoxyphenyl)methyl]acetamide has a molecular weight of 270.33 g/mol, XLogP of 2.14, 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-[(2-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 28711930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).