(2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene

C8H10 — CID 163465832

IUPAC(2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene
SMILESC[C@@]12CC1CC1C=C12
InChIInChI=1S/C8H10/c1-8-4-6(8)2-5-3-7(5)8/h3,5-6H,2,4H2,1H3/t5?,6?,8-/m1/s1
InChIKeyBSMQZFRWHYSKTJ-NPWHJSNTSA-N
MW106.17 g/mol
LogP1.97
Rot. Bonds

About (2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene

(2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene (PubChem CID 163465832) has the molecular formula C8H10 and a molecular weight of 106.17 g/mol. Its IUPAC name is (2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene.

Molecular Properties

Compound Name(2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene
PubChem CID163465832
Molecular FormulaC8H10
Molecular Weight106.17 g/mol
Exact Mass106.08
IUPAC Name(2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene
SMILESC[C@@]12CC1CC1C=C12
InChIInChI=1S/C8H10/c1-8-4-6(8)2-5-3-7(5)8/h3,5-6H,2,4H2,1H3/t5?,6?,8-/m1/s1
InChIKeyBSMQZFRWHYSKTJ-NPWHJSNTSA-N
XLogP1.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.17
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene 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 (2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene?
The IUPAC name of (2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene (CID 163465832) is (2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene.
What is the SMILES notation for (2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene?
The canonical SMILES for (2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene is C[C@@]12CC1CC1C=C12.
What is the InChIKey of (2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene?
The InChIKey is BSMQZFRWHYSKTJ-NPWHJSNTSA-N. The full InChI is InChI=1S/C8H10/c1-8-4-6(8)2-5-3-7(5)8/h3,5-6H,2,4H2,1H3/t5?,6?,8-/m1/s1.
What are the key properties of (2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene?
(2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene has a molecular weight of 106.17 g/mol, XLogP of 1.97, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyltricyclo[4.1.0.02,4]hept-1(7)-ene is sourced from PubChem (CID 163465832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).