(6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine

C13H14N4 — CID 135799858

IUPAC(6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine
SMILESNNC=C1C=CC=CC1/N=N/c1ccccc1
InChIInChI=1S/C13H14N4/c14-15-10-11-6-4-5-9-13(11)17-16-12-7-2-1-3-8-12/h1-10,13,15H,14H2/b11-10?,17-16+
InChIKeyPRNGBELGQIGDGO-VKSPINHISA-N
MW226.28 g/mol
LogP2.61
Rot. Bonds3

About (6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine

(6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine (PubChem CID 135799858) has the molecular formula C13H14N4 and a molecular weight of 226.28 g/mol. Its IUPAC name is (6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine.

Molecular Properties

Compound Name(6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine
PubChem CID135799858
Molecular FormulaC13H14N4
Molecular Weight226.28 g/mol
Exact Mass226.12
IUPAC Name(6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine
SMILESNNC=C1C=CC=CC1/N=N/c1ccccc1
InChIInChI=1S/C13H14N4/c14-15-10-11-6-4-5-9-13(11)17-16-12-7-2-1-3-8-12/h1-10,13,15H,14H2/b11-10?,17-16+
InChIKeyPRNGBELGQIGDGO-VKSPINHISA-N
XLogP2.61
TPSA62.77 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 52.61
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'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(1,3-dimethyl-2H-benzimidazol-2-yl)-phenyldiazene
CID 71367798
diphenyldiazene;hydrofluoride
CID 174857584
6-phenyldiazenylcyclohexa-2,4-diene-1,1-dicarbonitrile
CID 154086393
bis(diphenyldiazene);uranium;vanadium
CID 158886927
zinc;6-diazo-N-phenylcyclohexa-2,4-dien-1-amine;dichloride
CID 159688533
(5S)-5-phenyldiazenyl-4-sulfanylidene-1,3-thiazolidin-2-one
CID 7116164
6-diazo-N-phenylcyclohexa-2,4-dien-1-amine;formaldehyde
CID 87225473
5-phenyldiazenyl-2-sulfanylidene-1,3-thiazolidin-4-one
CID 3826649
4-[[4-[(4-phenyldiazenylphenyl)diazenyl]phenyl]diazenyl]aniline
CID 71332869
diphenyldiazene;urea
CID 175083568
2-amino-8-phenyldiazenylcyclooctan-1-one
CID 175187351
phenyl-[(1S,4S)-5-phenyldiazenyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]diazene
CID 10425266

Frequently Asked Questions

What is the IUPAC name of (6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine?
The IUPAC name of (6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine (CID 135799858) is (6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine.
What is the SMILES notation for (6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine?
The canonical SMILES for (6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine is NNC=C1C=CC=CC1/N=N/c1ccccc1.
What is the InChIKey of (6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine?
The InChIKey is PRNGBELGQIGDGO-VKSPINHISA-N. The full InChI is InChI=1S/C13H14N4/c14-15-10-11-6-4-5-9-13(11)17-16-12-7-2-1-3-8-12/h1-10,13,15H,14H2/b11-10?,17-16+.
What are the key properties of (6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine?
(6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine has a molecular weight of 226.28 g/mol, XLogP of 2.61, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-phenyldiazenylcyclohexa-2,4-dien-1-ylidene)methylhydrazine is sourced from PubChem (CID 135799858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).