1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine

C18H20N2 — CID 105224824

IUPAC1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine
SMILESNNC(CC1Cc2ccccc21)C1Cc2ccccc21
InChIInChI=1S/C18H20N2/c19-20-18(17-10-13-6-2-4-8-16(13)17)11-14-9-12-5-1-3-7-15(12)14/h1-8,14,17-18,20H,9-11,19H2
InChIKeyIGILHPNBERLANN-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.89
Rot. Bonds4

About 1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine

1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine (PubChem CID 105224824) has the molecular formula C18H20N2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine.

Molecular Properties

Compound Name1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine
PubChem CID105224824
Molecular FormulaC18H20N2
Molecular Weight264.37 g/mol
Exact Mass264.16
IUPAC Name1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine
SMILESNNC(CC1Cc2ccccc21)C1Cc2ccccc21
InChIInChI=1S/C18H20N2/c19-20-18(17-10-13-6-2-4-8-16(13)17)11-14-9-12-5-1-3-7-15(12)14/h1-8,14,17-18,20H,9-11,19H2
InChIKeyIGILHPNBERLANN-UHFFFAOYSA-N
XLogP2.89
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine?
The IUPAC name of 1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine (CID 105224824) is 1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine.
What is the SMILES notation for 1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine?
The canonical SMILES for 1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine is NNC(CC1Cc2ccccc21)C1Cc2ccccc21.
What is the InChIKey of 1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine?
The InChIKey is IGILHPNBERLANN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2/c19-20-18(17-10-13-6-2-4-8-16(13)17)11-14-9-12-5-1-3-7-15(12)14/h1-8,14,17-18,20H,9-11,19H2.
What are the key properties of 1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine?
1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine has a molecular weight of 264.37 g/mol, XLogP of 2.89, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethylhydrazine is sourced from PubChem (CID 105224824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).