N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide

C17H20N2O — CID 62057767

IUPACN-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2ccc(C)c(N)c2)cc1C
InChIInChI=1S/C17H20N2O/c1-11-4-6-14(8-13(11)3)9-17(20)19-15-7-5-12(2)16(18)10-15/h4-8,10H,9,18H2,1-3H3,(H,19,20)
InChIKeyHYTHJEXZSANWPJ-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.38
Rot. Bonds3

About N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide

N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide (PubChem CID 62057767) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide.

Molecular Properties

Compound NameN-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide
PubChem CID62057767
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC NameN-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2ccc(C)c(N)c2)cc1C
InChIInChI=1S/C17H20N2O/c1-11-4-6-14(8-13(11)3)9-17(20)19-15-7-5-12(2)16(18)10-15/h4-8,10H,9,18H2,1-3H3,(H,19,20)
InChIKeyHYTHJEXZSANWPJ-UHFFFAOYSA-N
XLogP3.38
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(3-amino-4-methylphenyl)-2-(3,4-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

Related Compounds

N,2-bis(3,4-dimethylphenyl)acetamide
CID 2600237
N-(3-amino-4-methylphenyl)-2-(3-hydroxyphenyl)acetamide
CID 61399667
2-(3,4-dimethylphenyl)-N-(4-methylphenyl)acetamide
CID 2664751
2-amino-N-(3-amino-4-methylphenyl)acetamide
CID 146654157
2-(3,4-dimethylphenyl)-N-(4-formylphenyl)acetamide
CID 106912167
2-(3,4-dichlorophenyl)-N-(3,4-dimethylphenyl)acetamide
CID 8743954
N-(3-amino-4-methylphenyl)-2-(2-chlorophenyl)acetamide
CID 24694774
2-(4-bromophenyl)-N-(3,4-dimethylphenyl)acetamide
CID 2268328
N-(3-amino-4-methylphenyl)-4-methylpentanamide
CID 28776905
N-(3,4-dimethylphenyl)-2-pyridin-4-ylacetamide
CID 110697303
N-(3,5-dimethoxyphenyl)-2-(3,4-dimethylphenyl)acetamide
CID 4803684
2-[2-(3-amino-4-methylanilino)-2-oxoethyl]sulfanylacetamide
CID 114231285

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide?
The IUPAC name of N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide (CID 62057767) is N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide.
What is the SMILES notation for N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide?
The canonical SMILES for N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide is Cc1ccc(CC(=O)Nc2ccc(C)c(N)c2)cc1C.
What is the InChIKey of N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide?
The InChIKey is HYTHJEXZSANWPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-11-4-6-14(8-13(11)3)9-17(20)19-15-7-5-12(2)16(18)10-15/h4-8,10H,9,18H2,1-3H3,(H,19,20).
What are the key properties of N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide?
N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide has a molecular weight of 268.36 g/mol, XLogP of 3.38, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide is sourced from PubChem (CID 62057767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).