2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide

C16H18N2O2 — CID 81318026

IUPAC2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide
SMILESNCc1ccccc1CC(=O)Nc1cccc(CO)c1
InChIInChI=1S/C16H18N2O2/c17-10-14-6-2-1-5-13(14)9-16(20)18-15-7-3-4-12(8-15)11-19/h1-8,19H,9-11,17H2,(H,18,20)
InChIKeyGYKUGSFIZFODQH-UHFFFAOYSA-N
MW270.33 g/mol
LogP1.82
Rot. Bonds5

About 2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide

2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide (PubChem CID 81318026) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide
PubChem CID81318026
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide
SMILESNCc1ccccc1CC(=O)Nc1cccc(CO)c1
InChIInChI=1S/C16H18N2O2/c17-10-14-6-2-1-5-13(14)9-16(20)18-15-7-3-4-12(8-15)11-19/h1-8,19H,9-11,17H2,(H,18,20)
InChIKeyGYKUGSFIZFODQH-UHFFFAOYSA-N
XLogP1.82
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 51.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[[2-[2-(aminomethyl)phenyl]acetyl]amino]benzamide
CID 81312309
N-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide
CID 81313310
4-amino-N-[3-(hydroxymethyl)phenyl]butanamide
CID 43707512
N-[3-(hydroxymethyl)phenyl]propanamide
CID 12959862
2-(5-amino-2-pyridinyl)-N-[3-(hydroxymethyl)phenyl]acetamide
CID 107337793
2-[3-(aminomethyl)phenyl]-N-phenylacetamide
CID 154574877
3-(aminomethyl)-N-[3-(hydroxymethyl)phenyl]pentanamide
CID 81075870
2-[4-(aminomethyl)phenyl]-N-(3-ethylphenyl)acetamide
CID 63589585
2-[2-(aminomethyl)phenyl]-N-(3-hydroxy-4-methylphenyl)acetamide
CID 107701531
2-(2-aminophenyl)-N-(3-ethylphenyl)acetamide
CID 16785552
[2-[3-(hydroxymethyl)anilino]-2-oxoethyl]phosphonic acid
CID 54125815
N-[3-(hydroxymethyl)phenyl]-4-oxopentanamide
CID 62197477

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide?
The IUPAC name of 2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide (CID 81318026) is 2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide.
What is the SMILES notation for 2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide?
The canonical SMILES for 2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide is NCc1ccccc1CC(=O)Nc1cccc(CO)c1.
What is the InChIKey of 2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide?
The InChIKey is GYKUGSFIZFODQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c17-10-14-6-2-1-5-13(14)9-16(20)18-15-7-3-4-12(8-15)11-19/h1-8,19H,9-11,17H2,(H,18,20).
What are the key properties of 2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide?
2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide has a molecular weight of 270.33 g/mol, XLogP of 1.82, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide is sourced from PubChem (CID 81318026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).