9-methylbicyclo[6.1.0]nonane

C10H18 — CID 12870201

IUPAC9-methylbicyclo[6.1.0]nonane
SMILESCC1C2CCCCCCC12
InChIInChI=1S/C10H18/c1-8-9-6-4-2-3-5-7-10(8)9/h8-10H,2-7H2,1H3
InChIKeyJWNUSGIHDNWRIQ-UHFFFAOYSA-N
MW138.25 g/mol
LogP3.22
Rot. Bonds

About 9-methylbicyclo[6.1.0]nonane

9-methylbicyclo[6.1.0]nonane (PubChem CID 12870201) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is 9-methylbicyclo[6.1.0]nonane.

Molecular Properties

Compound Name9-methylbicyclo[6.1.0]nonane
PubChem CID12870201
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Name9-methylbicyclo[6.1.0]nonane
SMILESCC1C2CCCCCCC12
InChIInChI=1S/C10H18/c1-8-9-6-4-2-3-5-7-10(8)9/h8-10H,2-7H2,1H3
InChIKeyJWNUSGIHDNWRIQ-UHFFFAOYSA-N
XLogP3.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.25
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 9-methylbicyclo[6.1.0]nonane?
The IUPAC name of 9-methylbicyclo[6.1.0]nonane (CID 12870201) is 9-methylbicyclo[6.1.0]nonane.
What is the SMILES notation for 9-methylbicyclo[6.1.0]nonane?
The canonical SMILES for 9-methylbicyclo[6.1.0]nonane is CC1C2CCCCCCC12.
What is the InChIKey of 9-methylbicyclo[6.1.0]nonane?
The InChIKey is JWNUSGIHDNWRIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18/c1-8-9-6-4-2-3-5-7-10(8)9/h8-10H,2-7H2,1H3.
What are the key properties of 9-methylbicyclo[6.1.0]nonane?
9-methylbicyclo[6.1.0]nonane has a molecular weight of 138.25 g/mol, XLogP of 3.22, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methylbicyclo[6.1.0]nonane is sourced from PubChem (CID 12870201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).