(5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene

C13H20O — CID 14939527

IUPAC(5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene
SMILESCC(C)OC1C=CC2C3CCC(C3)C12
InChIInChI=1S/C13H20O/c1-8(2)14-12-6-5-11-9-3-4-10(7-9)13(11)12/h5-6,8-13H,3-4,7H2,1-2H3
InChIKeyWROKZMYYCNBMFJ-UHFFFAOYSA-N
MW192.30 g/mol
LogP3.01
Rot. Bonds2

About (5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene

(5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene (PubChem CID 14939527) has the molecular formula C13H20O and a molecular weight of 192.30 g/mol. Its IUPAC name is (5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene.

Molecular Properties

Compound Name(5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene
PubChem CID14939527
Molecular FormulaC13H20O
Molecular Weight192.30 g/mol
Exact Mass192.15
IUPAC Name(5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene
SMILESCC(C)OC1C=CC2C3CCC(C3)C12
InChIInChI=1S/C13H20O/c1-8(2)14-12-6-5-11-9-3-4-10(7-9)13(11)12/h5-6,8-13H,3-4,7H2,1-2H3
InChIKeyWROKZMYYCNBMFJ-UHFFFAOYSA-N
XLogP3.01
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.30
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-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 (5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene?
The IUPAC name of (5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene (CID 14939527) is (5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene.
What is the SMILES notation for (5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene?
The canonical SMILES for (5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene is CC(C)OC1C=CC2C3CCC(C3)C12.
What is the InChIKey of (5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene?
The InChIKey is WROKZMYYCNBMFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O/c1-8(2)14-12-6-5-11-9-3-4-10(7-9)13(11)12/h5-6,8-13H,3-4,7H2,1-2H3.
What are the key properties of (5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene?
(5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene has a molecular weight of 192.30 g/mol, XLogP of 3.01, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-propan-2-yloxytricyclo[5.2.1.02,6]dec-3-ene is sourced from PubChem (CID 14939527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).