2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide

C16H18N2O — CID 16794842

IUPAC2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide
SMILESCc1cccc(NC(=O)Cc2ccccc2N)c1C
InChIInChI=1S/C16H18N2O/c1-11-6-5-9-15(12(11)2)18-16(19)10-13-7-3-4-8-14(13)17/h3-9H,10,17H2,1-2H3,(H,18,19)
InChIKeyDRSDDFPRNDKQSU-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.07
Rot. Bonds3

About 2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide

2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide (PubChem CID 16794842) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide
PubChem CID16794842
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide
SMILESCc1cccc(NC(=O)Cc2ccccc2N)c1C
InChIInChI=1S/C16H18N2O/c1-11-6-5-9-15(12(11)2)18-16(19)10-13-7-3-4-8-14(13)17/h3-9H,10,17H2,1-2H3,(H,18,19)
InChIKeyDRSDDFPRNDKQSU-UHFFFAOYSA-N
XLogP3.07
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide?
The IUPAC name of 2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide (CID 16794842) is 2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide?
The canonical SMILES for 2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide is Cc1cccc(NC(=O)Cc2ccccc2N)c1C.
What is the InChIKey of 2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide?
The InChIKey is DRSDDFPRNDKQSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-11-6-5-9-15(12(11)2)18-16(19)10-13-7-3-4-8-14(13)17/h3-9H,10,17H2,1-2H3,(H,18,19).
What are the key properties of 2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide?
2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide has a molecular weight of 254.33 g/mol, XLogP of 3.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide is sourced from PubChem (CID 16794842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).