6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene

C8H11N — CID 88563171

IUPAC6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene
SMILESCC1C2=C(N=CC2)C1C
InChIInChI=1S/C8H11N/c1-5-6(2)8-7(5)3-4-9-8/h4-6H,3H2,1-2H3
InChIKeyAJBYRKHWLGSWNN-UHFFFAOYSA-N
MW121.18 g/mol
LogP2.00
Rot. Bonds

About 6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene

6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene (PubChem CID 88563171) has the molecular formula C8H11N and a molecular weight of 121.18 g/mol. Its IUPAC name is 6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene.

Molecular Properties

Compound Name6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene
PubChem CID88563171
Molecular FormulaC8H11N
Molecular Weight121.18 g/mol
Exact Mass121.09
IUPAC Name6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene
SMILESCC1C2=C(N=CC2)C1C
InChIInChI=1S/C8H11N/c1-5-6(2)8-7(5)3-4-9-8/h4-6H,3H2,1-2H3
InChIKeyAJBYRKHWLGSWNN-UHFFFAOYSA-N
XLogP2.00
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.18
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene with MolForge

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

Launch Full Analysis

Related Compounds

3-ethyl-4-methyl-5-(2-methylpropyl)-3H-pyrrole
CID 59359592
5-ethyl-4,5,6,7-tetrahydro-3H-indole
CID 68040987
3,5-dimethyl-4-propyl-3H-pyrrole
CID 69174213
5-methyl-4,5,6,7-tetrahydro-3H-indole
CID 70571864
5-methyl-4,5,6,7-tetrahydro-3H-cyclopenta[b]pyridine
CID 89185960
6-Methyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene
CID 89263276
7-Methyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene
CID 89263292
N-(2,4-dimethylcyclobuten-1-yl)ethanimine
CID 89263311
6,7-Dimethyl-4-methylidene-2-azabicyclo[3.2.0]hepta-1(5),2-diene
CID 89263387
3,6,7-trimethyl-4,5-dihydro-3H-azepine
CID 91279231
N-[(1E)-1-(2-methylcyclopentylidene)ethyl]propan-1-imine
CID 123222219
3-Ethyl-4,5-dimethyl-6-(3-methylbutyl)-3,4-dihydropyridine
CID 123463848

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene?
The IUPAC name of 6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene (CID 88563171) is 6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene.
What is the SMILES notation for 6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene?
The canonical SMILES for 6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene is CC1C2=C(N=CC2)C1C.
What is the InChIKey of 6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene?
The InChIKey is AJBYRKHWLGSWNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N/c1-5-6(2)8-7(5)3-4-9-8/h4-6H,3H2,1-2H3.
What are the key properties of 6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene?
6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene has a molecular weight of 121.18 g/mol, XLogP of 2.00, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-2-azabicyclo[3.2.0]hepta-1(5),2-diene is sourced from PubChem (CID 88563171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).