1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine

C12H14N2 — CID 155699448

IUPAC1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine
SMILESC1=CC(NNc2ccccc2)=CCC1
InChIInChI=1S/C12H14N2/c1-3-7-11(8-4-1)13-14-12-9-5-2-6-10-12/h1,3-5,7-10,13-14H,2,6H2
InChIKeyBPGQXHNLMLGWPI-UHFFFAOYSA-N
MW186.26 g/mol
LogP2.84
Rot. Bonds3

About 1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine

1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine (PubChem CID 155699448) has the molecular formula C12H14N2 and a molecular weight of 186.26 g/mol. Its IUPAC name is 1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine.

Molecular Properties

Compound Name1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine
PubChem CID155699448
Molecular FormulaC12H14N2
Molecular Weight186.26 g/mol
Exact Mass186.12
IUPAC Name1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine
SMILESC1=CC(NNc2ccccc2)=CCC1
InChIInChI=1S/C12H14N2/c1-3-7-11(8-4-1)13-14-12-9-5-2-6-10-12/h1,3-5,7-10,13-14H,2,6H2
InChIKeyBPGQXHNLMLGWPI-UHFFFAOYSA-N
XLogP2.84
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.26
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexa-1,5-dien-1-yl-N'-phenylethane-1,2-diamine
CID 71090761
5-N-cyclohexa-1,5-dien-1-yl-1-N,3-N-diphenylbenzene-1,3,5-tricarboxamide
CID 144544325
1-phenyl-2-[4-(2-phenylhydrazinyl)phenyl]hydrazine
CID 169215100
1,2-diphenylhydrazine;hydrobromide
CID 162337860
3-N-cyclohexa-1,5-dien-1-ylbenzene-1,3-diamine
CID 156839435
1,2-diphenylhydrazine;hydrazine
CID 161098943
1-phenyl-2-(5-pyrrolidin-1-ium-1-ylcyclohexa-1,5-dien-1-yl)hydrazine
CID 2317469
N-cyclohexa-1,5-dien-1-yltriphenylen-1-amine;ethane
CID 145280455
N-[(1E,3Z)-4-cyclohexa-1,5-dien-1-ylbuta-1,3-dienyl]aniline
CID 155273874
1-(cyclohexen-1-yl)-2-phenylhydrazine
CID 54141218
cyclohexa-1,5-dien-1-ylbenzene;methane
CID 156791104
N-ethylcyclohexa-1,5-dien-1-amine
CID 18448807

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine?
The IUPAC name of 1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine (CID 155699448) is 1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine.
What is the SMILES notation for 1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine?
The canonical SMILES for 1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine is C1=CC(NNc2ccccc2)=CCC1.
What is the InChIKey of 1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine?
The InChIKey is BPGQXHNLMLGWPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2/c1-3-7-11(8-4-1)13-14-12-9-5-2-6-10-12/h1,3-5,7-10,13-14H,2,6H2.
What are the key properties of 1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine?
1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine has a molecular weight of 186.26 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexa-1,5-dien-1-yl-2-phenylhydrazine is sourced from PubChem (CID 155699448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).