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

C16H16N4O2 — CID 27289

IUPACN-[4-[(4-acetamidophenyl)diazenyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(/N=N/c2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C16H16N4O2/c1-11(21)17-13-3-7-15(8-4-13)19-20-16-9-5-14(6-10-16)18-12(2)22/h3-10H,1-2H3,(H,17,21)(H,18,22)/b20-19+
InChIKeyJLFZFBSUNFGETA-FMQUCBEESA-N
MW296.33 g/mol
LogP4.02
Rot. Bonds4

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

N-[4-[(4-acetamidophenyl)diazenyl]phenyl]acetamide (PubChem CID 27289) has the molecular formula C16H16N4O2 and a molecular weight of 296.33 g/mol. Its IUPAC name is N-[4-[(4-acetamidophenyl)diazenyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(4-acetamidophenyl)diazenyl]phenyl]acetamide
PubChem CID27289
Molecular FormulaC16H16N4O2
Molecular Weight296.33 g/mol
Exact Mass296.13
IUPAC NameN-[4-[(4-acetamidophenyl)diazenyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(/N=N/c2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C16H16N4O2/c1-11(21)17-13-3-7-15(8-4-13)19-20-16-9-5-14(6-10-16)18-12(2)22/h3-10H,1-2H3,(H,17,21)(H,18,22)/b20-19+
InChIKeyJLFZFBSUNFGETA-FMQUCBEESA-N
XLogP4.02
TPSA82.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 54.02
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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Related Compounds

Acetanilide
CID 904
2-Methylacetanilide
CID 12107
m-Aminoacetanilide
CID 7604
4-Aminoacetanilide
CID 31230
Adipic dianilide
CID 20523
Oxanilide
CID 69288
N-Phenylbutanamide
CID 14323
4'-(Phenylazo)acetanilide
CID 20085
N-[4-(phenylamino)phenyl]acetamide
CID 789635
N,N'-diacetyl-p-phenylenediamine
CID 67324
N-Acetyl-1,2-diphenylhydrazine
CID 140901
Malonanilide
CID 69298

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-acetamidophenyl)diazenyl]phenyl]acetamide?
The IUPAC name of N-[4-[(4-acetamidophenyl)diazenyl]phenyl]acetamide (CID 27289) is N-[4-[(4-acetamidophenyl)diazenyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(4-acetamidophenyl)diazenyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(4-acetamidophenyl)diazenyl]phenyl]acetamide is CC(=O)Nc1ccc(/N=N/c2ccc(NC(C)=O)cc2)cc1.
What is the InChIKey of N-[4-[(4-acetamidophenyl)diazenyl]phenyl]acetamide?
The InChIKey is JLFZFBSUNFGETA-FMQUCBEESA-N. The full InChI is InChI=1S/C16H16N4O2/c1-11(21)17-13-3-7-15(8-4-13)19-20-16-9-5-14(6-10-16)18-12(2)22/h3-10H,1-2H3,(H,17,21)(H,18,22)/b20-19+.
What are the key properties of N-[4-[(4-acetamidophenyl)diazenyl]phenyl]acetamide?
N-[4-[(4-acetamidophenyl)diazenyl]phenyl]acetamide has a molecular weight of 296.33 g/mol, XLogP of 4.02, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-acetamidophenyl)diazenyl]phenyl]acetamide is sourced from PubChem (CID 27289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).