2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide

C16H18N2O2 — CID 61115894

IUPAC2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide
SMILESCN(Cc1ccccc1O)C(=O)Cc1ccccc1N
InChIInChI=1S/C16H18N2O2/c1-18(11-13-7-3-5-9-15(13)19)16(20)10-12-6-2-4-8-14(12)17/h2-9,19H,10-11,17H2,1H3
InChIKeyDOUMAIUVRPXLHH-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.18
Rot. Bonds4

About 2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide

2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide (PubChem CID 61115894) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide
PubChem CID61115894
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide
SMILESCN(Cc1ccccc1O)C(=O)Cc1ccccc1N
InChIInChI=1S/C16H18N2O2/c1-18(11-13-7-3-5-9-15(13)19)16(20)10-12-6-2-4-8-14(12)17/h2-9,19H,10-11,17H2,1H3
InChIKeyDOUMAIUVRPXLHH-UHFFFAOYSA-N
XLogP2.18
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide 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

2-(2-aminophenyl)-N-[(2-chlorophenyl)methyl]-N-methylacetamide
CID 61117245
N-[(2-aminophenyl)methyl]-2-(2-fluorophenyl)-N-methylacetamide
CID 43458424
2-chloro-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide
CID 60809822
2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 43527191
2-(2-aminophenyl)-N,N-dimethylacetamide;hydrochloride
CID 141352115
2-(2-aminophenyl)-N-[(3-chlorophenyl)methyl]-N-methylacetamide
CID 61117260
2-(2-aminophenyl)-N-[(2-chloro-6-fluorophenyl)methyl]-N-methylacetamide
CID 61115408
2-(2-aminophenyl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide
CID 61115422
1-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylmethanesulfonamide
CID 62022053
2-[benzyl(methyl)amino]-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide
CID 86861731
2-(2-aminophenyl)-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]acetamide
CID 61110220
N-[[3-(aminomethyl)phenyl]methyl]-2-(2-hydroxyphenyl)-N-methylacetamide
CID 80743611

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide?
The IUPAC name of 2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide (CID 61115894) is 2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide?
The canonical SMILES for 2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide is CN(Cc1ccccc1O)C(=O)Cc1ccccc1N.
What is the InChIKey of 2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide?
The InChIKey is DOUMAIUVRPXLHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-18(11-13-7-3-5-9-15(13)19)16(20)10-12-6-2-4-8-14(12)17/h2-9,19H,10-11,17H2,1H3.
What are the key properties of 2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide?
2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide has a molecular weight of 270.33 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-[(2-hydroxyphenyl)methyl]-N-methylacetamide is sourced from PubChem (CID 61115894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).