7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene

C8H10N2 — CID 89317326

IUPAC7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene
SMILESCn1c2ccccc2n1C
InChIInChI=1S/C8H10N2/c1-9-7-5-3-4-6-8(7)10(9)2/h3-6H,1-2H3
InChIKeyQAEUFEWUWWUXMC-UHFFFAOYSA-N
MW134.18 g/mol
LogP1.52
Rot. Bonds

About 7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene

7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene (PubChem CID 89317326) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is 7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene.

Molecular Properties

Compound Name7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene
PubChem CID89317326
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene
SMILESCn1c2ccccc2n1C
InChIInChI=1S/C8H10N2/c1-9-7-5-3-4-6-8(7)10(9)2/h3-6H,1-2H3
InChIKeyQAEUFEWUWWUXMC-UHFFFAOYSA-N
XLogP1.52
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene?
The IUPAC name of 7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene (CID 89317326) is 7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene.
What is the SMILES notation for 7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene?
The canonical SMILES for 7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene is Cn1c2ccccc2n1C.
What is the InChIKey of 7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene?
The InChIKey is QAEUFEWUWWUXMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-9-7-5-3-4-6-8(7)10(9)2/h3-6H,1-2H3.
What are the key properties of 7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene?
7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene has a molecular weight of 134.18 g/mol, XLogP of 1.52, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dimethyl-7,8-diazabicyclo[4.2.0]octa-1,3,5-triene is sourced from PubChem (CID 89317326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).