N-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide

C14H13N3O2 — CID 21373

IUPACN-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(/N=N/c2ccc(O)cc2)cc1
InChIInChI=1S/C14H13N3O2/c1-10(18)15-11-2-4-12(5-3-11)16-17-13-6-8-14(19)9-7-13/h2-9,19H,1H3,(H,15,18)/b17-16+
InChIKeyDXKBMLFQENYTOP-WUKNDPDISA-N
MW255.28 g/mol
LogP3.77
Rot. Bonds3

About N-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide

N-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide (PubChem CID 21373) has the molecular formula C14H13N3O2 and a molecular weight of 255.28 g/mol. Its IUPAC name is N-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide
PubChem CID21373
Molecular FormulaC14H13N3O2
Molecular Weight255.28 g/mol
Exact Mass255.10
IUPAC NameN-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(/N=N/c2ccc(O)cc2)cc1
InChIInChI=1S/C14H13N3O2/c1-10(18)15-11-2-4-12(5-3-11)16-17-13-6-8-14(19)9-7-13/h2-9,19H,1H3,(H,15,18)/b17-16+
InChIKeyDXKBMLFQENYTOP-WUKNDPDISA-N
XLogP3.77
TPSA74.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide?
The IUPAC name of N-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide (CID 21373) is N-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide is CC(=O)Nc1ccc(/N=N/c2ccc(O)cc2)cc1.
What is the InChIKey of N-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide?
The InChIKey is DXKBMLFQENYTOP-WUKNDPDISA-N. The full InChI is InChI=1S/C14H13N3O2/c1-10(18)15-11-2-4-12(5-3-11)16-17-13-6-8-14(19)9-7-13/h2-9,19H,1H3,(H,15,18)/b17-16+.
What are the key properties of N-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide?
N-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide has a molecular weight of 255.28 g/mol, XLogP of 3.77, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-hydroxyphenyl)diazenyl]phenyl]acetamide is sourced from PubChem (CID 21373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).