(1S,8R)-9-methylidenebicyclo[6.1.0]nonane

C10H16 — CID 11768638

IUPAC(1S,8R)-9-methylidenebicyclo[6.1.0]nonane
SMILESC=C1[C@H]2CCCCCC[C@@H]12
InChIInChI=1S/C10H16/c1-8-9-6-4-2-3-5-7-10(8)9/h9-10H,1-7H2/t9-,10+
InChIKeyGKZLSOVFHTYFFI-AOOOYVTPSA-N
MW136.24 g/mol
LogP3.14
Rot. Bonds

About (1S,8R)-9-methylidenebicyclo[6.1.0]nonane

(1S,8R)-9-methylidenebicyclo[6.1.0]nonane (PubChem CID 11768638) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is (1S,8R)-9-methylidenebicyclo[6.1.0]nonane.

Molecular Properties

Compound Name(1S,8R)-9-methylidenebicyclo[6.1.0]nonane
PubChem CID11768638
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name(1S,8R)-9-methylidenebicyclo[6.1.0]nonane
SMILESC=C1[C@H]2CCCCCC[C@@H]12
InChIInChI=1S/C10H16/c1-8-9-6-4-2-3-5-7-10(8)9/h9-10H,1-7H2/t9-,10+
InChIKeyGKZLSOVFHTYFFI-AOOOYVTPSA-N
XLogP3.14
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 ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1S,8R)-9-methylidenebicyclo[6.1.0]nonane?
The IUPAC name of (1S,8R)-9-methylidenebicyclo[6.1.0]nonane (CID 11768638) is (1S,8R)-9-methylidenebicyclo[6.1.0]nonane.
What is the SMILES notation for (1S,8R)-9-methylidenebicyclo[6.1.0]nonane?
The canonical SMILES for (1S,8R)-9-methylidenebicyclo[6.1.0]nonane is C=C1[C@H]2CCCCCC[C@@H]12.
What is the InChIKey of (1S,8R)-9-methylidenebicyclo[6.1.0]nonane?
The InChIKey is GKZLSOVFHTYFFI-AOOOYVTPSA-N. The full InChI is InChI=1S/C10H16/c1-8-9-6-4-2-3-5-7-10(8)9/h9-10H,1-7H2/t9-,10+.
What are the key properties of (1S,8R)-9-methylidenebicyclo[6.1.0]nonane?
(1S,8R)-9-methylidenebicyclo[6.1.0]nonane has a molecular weight of 136.24 g/mol, XLogP of 3.14, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,8R)-9-methylidenebicyclo[6.1.0]nonane is sourced from PubChem (CID 11768638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).