(1R,8R)-bicyclo[6.1.0]nonane

C9H16 — CID 12502931

IUPAC(1R,8R)-bicyclo[6.1.0]nonane
SMILESC1CCC[C@@H]2C[C@H]2CC1
InChIInChI=1S/C9H16/c1-2-4-6-9-7-8(9)5-3-1/h8-9H,1-7H2/t8-,9-/m1/s1
InChIKeyFYECUAIUGWFPJF-RKDXNWHRSA-N
MW124.23 g/mol
LogP2.98
Rot. Bonds

About (1R,8R)-bicyclo[6.1.0]nonane

(1R,8R)-bicyclo[6.1.0]nonane (PubChem CID 12502931) has the molecular formula C9H16 and a molecular weight of 124.23 g/mol. Its IUPAC name is (1R,8R)-bicyclo[6.1.0]nonane.

Molecular Properties

Compound Name(1R,8R)-bicyclo[6.1.0]nonane
PubChem CID12502931
Molecular FormulaC9H16
Molecular Weight124.23 g/mol
Exact Mass124.13
IUPAC Name(1R,8R)-bicyclo[6.1.0]nonane
SMILESC1CCC[C@@H]2C[C@H]2CC1
InChIInChI=1S/C9H16/c1-2-4-6-9-7-8(9)5-3-1/h8-9H,1-7H2/t8-,9-/m1/s1
InChIKeyFYECUAIUGWFPJF-RKDXNWHRSA-N
XLogP2.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.23
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (1R,8R)-bicyclo[6.1.0]nonane 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,8R)-bicyclo[6.1.0]nonane?
The IUPAC name of (1R,8R)-bicyclo[6.1.0]nonane (CID 12502931) is (1R,8R)-bicyclo[6.1.0]nonane.
What is the SMILES notation for (1R,8R)-bicyclo[6.1.0]nonane?
The canonical SMILES for (1R,8R)-bicyclo[6.1.0]nonane is C1CCC[C@@H]2C[C@H]2CC1.
What is the InChIKey of (1R,8R)-bicyclo[6.1.0]nonane?
The InChIKey is FYECUAIUGWFPJF-RKDXNWHRSA-N. The full InChI is InChI=1S/C9H16/c1-2-4-6-9-7-8(9)5-3-1/h8-9H,1-7H2/t8-,9-/m1/s1.
What are the key properties of (1R,8R)-bicyclo[6.1.0]nonane?
(1R,8R)-bicyclo[6.1.0]nonane has a molecular weight of 124.23 g/mol, XLogP of 2.98, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,8R)-bicyclo[6.1.0]nonane is sourced from PubChem (CID 12502931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).