N-(5-methyl-2-phenyldiazenylphenyl)acetamide

C15H15N3O — CID 154602849

IUPACN-(5-methyl-2-phenyldiazenylphenyl)acetamide
SMILESCC(=O)Nc1cc(C)ccc1/N=N/c1ccccc1
InChIInChI=1S/C15H15N3O/c1-11-8-9-14(15(10-11)16-12(2)19)18-17-13-6-4-3-5-7-13/h3-10H,1-2H3,(H,16,19)/b18-17+
InChIKeyPNQDPIDOJCYYJN-ISLYRVAYSA-N
MW253.31 g/mol
LogP4.37
Rot. Bonds3

About N-(5-methyl-2-phenyldiazenylphenyl)acetamide

N-(5-methyl-2-phenyldiazenylphenyl)acetamide (PubChem CID 154602849) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is N-(5-methyl-2-phenyldiazenylphenyl)acetamide.

Molecular Properties

Compound NameN-(5-methyl-2-phenyldiazenylphenyl)acetamide
PubChem CID154602849
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC NameN-(5-methyl-2-phenyldiazenylphenyl)acetamide
SMILESCC(=O)Nc1cc(C)ccc1/N=N/c1ccccc1
InChIInChI=1S/C15H15N3O/c1-11-8-9-14(15(10-11)16-12(2)19)18-17-13-6-4-3-5-7-13/h3-10H,1-2H3,(H,16,19)/b18-17+
InChIKeyPNQDPIDOJCYYJN-ISLYRVAYSA-N
XLogP4.37
TPSA53.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 54.37
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'}

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-2-phenyldiazenylphenyl)acetamide?
The IUPAC name of N-(5-methyl-2-phenyldiazenylphenyl)acetamide (CID 154602849) is N-(5-methyl-2-phenyldiazenylphenyl)acetamide.
What is the SMILES notation for N-(5-methyl-2-phenyldiazenylphenyl)acetamide?
The canonical SMILES for N-(5-methyl-2-phenyldiazenylphenyl)acetamide is CC(=O)Nc1cc(C)ccc1/N=N/c1ccccc1.
What is the InChIKey of N-(5-methyl-2-phenyldiazenylphenyl)acetamide?
The InChIKey is PNQDPIDOJCYYJN-ISLYRVAYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-11-8-9-14(15(10-11)16-12(2)19)18-17-13-6-4-3-5-7-13/h3-10H,1-2H3,(H,16,19)/b18-17+.
What are the key properties of N-(5-methyl-2-phenyldiazenylphenyl)acetamide?
N-(5-methyl-2-phenyldiazenylphenyl)acetamide has a molecular weight of 253.31 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-2-phenyldiazenylphenyl)acetamide is sourced from PubChem (CID 154602849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).