2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide

C16H18N4O — CID 135021683

IUPAC2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide
SMILESCc1ccc(N(C)C(=O)C(/N=N/N)c2ccccc2)cc1
InChIInChI=1S/C16H18N4O/c1-12-8-10-14(11-9-12)20(2)16(21)15(18-19-17)13-6-4-3-5-7-13/h3-11,15H,1-2H3,(H2,17,18)
InChIKeyXRNOERPETZYIIV-UHFFFAOYSA-N
MW282.35 g/mol
LogP3.03
Rot. Bonds4

About 2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide

2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide (PubChem CID 135021683) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is 2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide.

Molecular Properties

Compound Name2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide
PubChem CID135021683
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide
SMILESCc1ccc(N(C)C(=O)C(/N=N/N)c2ccccc2)cc1
InChIInChI=1S/C16H18N4O/c1-12-8-10-14(11-9-12)20(2)16(21)15(18-19-17)13-6-4-3-5-7-13/h3-11,15H,1-2H3,(H2,17,18)
InChIKeyXRNOERPETZYIIV-UHFFFAOYSA-N
XLogP3.03
TPSA71.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide 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-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide
CID 115179676
2-amino-N-(4-fluorophenyl)-N-methyl-2-(4-methylphenyl)acetamide
CID 106151346
2-amino-N-methyl-N-(3-methylphenyl)-2-phenylacetamide
CID 76931148
3-amino-N-(4-hydroxyphenyl)-N,2-dimethyl-3-phenylpropanamide
CID 107734254
3,3-dimethyl-2-[methyl-(4-methylphenyl)carbamoyl]butanoic acid
CID 116537045
2-cyano-N-(4-methoxyphenyl)-N-methyl-2-phenylacetamide
CID 62879005
2-chloro-N-(4-hydroxyphenyl)-N-methyl-2-phenylacetamide
CID 82110850
3-amino-N,2-dimethyl-N-(4-phenylphenyl)propanamide
CID 115153554
2-amino-N-(4-hydroxyphenyl)-N-methylpropanamide
CID 23221170
3-amino-N-(4-fluorophenyl)-N-methyl-2-phenylpropanamide
CID 62876632
3-amino-N,2-dimethyl-N-[1-(4-methylphenyl)ethyl]-3-phenylpropanamide
CID 119717391
3-chloro-N,2-dimethyl-N-(4-methylphenyl)propanamide
CID 62726677

Frequently Asked Questions

What is the IUPAC name of 2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide?
The IUPAC name of 2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide (CID 135021683) is 2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide.
What is the SMILES notation for 2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide?
The canonical SMILES for 2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide is Cc1ccc(N(C)C(=O)C(/N=N/N)c2ccccc2)cc1.
What is the InChIKey of 2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide?
The InChIKey is XRNOERPETZYIIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c1-12-8-10-14(11-9-12)20(2)16(21)15(18-19-17)13-6-4-3-5-7-13/h3-11,15H,1-2H3,(H2,17,18).
What are the key properties of 2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide?
2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide has a molecular weight of 282.35 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminodiazenyl)-N-methyl-N-(4-methylphenyl)-2-phenylacetamide is sourced from PubChem (CID 135021683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).