(1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane

C10H16 — CID 163034296

IUPAC(1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane
SMILESCC1(C)[C@H]2CC[C@@H]3[C@H]2[C@@]31C
InChIInChI=1S/C10H16/c1-9(2)6-4-5-7-8(6)10(7,9)3/h6-8H,4-5H2,1-3H3/t6-,7+,8-,10+/m0/s1
InChIKeyWMLCBYLGIDOUMQ-PYHGXSLLSA-N
MW136.24 g/mol
LogP2.69
Rot. Bonds

About (1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane

(1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane (PubChem CID 163034296) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is (1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane.

Molecular Properties

Compound Name(1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane
PubChem CID163034296
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name(1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane
SMILESCC1(C)[C@H]2CC[C@@H]3[C@H]2[C@@]31C
InChIInChI=1S/C10H16/c1-9(2)6-4-5-7-8(6)10(7,9)3/h6-8H,4-5H2,1-3H3/t6-,7+,8-,10+/m0/s1
InChIKeyWMLCBYLGIDOUMQ-PYHGXSLLSA-N
XLogP2.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane 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 (1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane?
The IUPAC name of (1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane (CID 163034296) is (1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane.
What is the SMILES notation for (1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane?
The canonical SMILES for (1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane is CC1(C)[C@H]2CC[C@@H]3[C@H]2[C@@]31C.
What is the InChIKey of (1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane?
The InChIKey is WMLCBYLGIDOUMQ-PYHGXSLLSA-N. The full InChI is InChI=1S/C10H16/c1-9(2)6-4-5-7-8(6)10(7,9)3/h6-8H,4-5H2,1-3H3/t6-,7+,8-,10+/m0/s1.
What are the key properties of (1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane?
(1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane has a molecular weight of 136.24 g/mol, XLogP of 2.69, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R,5S,7R)-6,6,7-trimethyltricyclo[3.2.0.02,7]heptane is sourced from PubChem (CID 163034296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).