2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane

C17H28 — CID 59850617

IUPAC2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane
SMILESCC(C)C1(C2CCC2)C(C)C12C(C)C21CCC1
InChIInChI=1S/C17H28/c1-11(2)16(14-7-5-8-14)13(4)17(16)12(3)15(17)9-6-10-15/h11-14H,5-10H2,1-4H3
InChIKeyOKPBCVKUPBYAKI-UHFFFAOYSA-N
MW232.41 g/mol
LogP4.89
Rot. Bonds2

About 2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane

2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane (PubChem CID 59850617) has the molecular formula C17H28 and a molecular weight of 232.41 g/mol. Its IUPAC name is 2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane.

Molecular Properties

Compound Name2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane
PubChem CID59850617
Molecular FormulaC17H28
Molecular Weight232.41 g/mol
Exact Mass232.22
IUPAC Name2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane
SMILESCC(C)C1(C2CCC2)C(C)C12C(C)C21CCC1
InChIInChI=1S/C17H28/c1-11(2)16(14-7-5-8-14)13(4)17(16)12(3)15(17)9-6-10-15/h11-14H,5-10H2,1-4H3
InChIKeyOKPBCVKUPBYAKI-UHFFFAOYSA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.41
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane?
The IUPAC name of 2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane (CID 59850617) is 2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane.
What is the SMILES notation for 2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane?
The canonical SMILES for 2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane is CC(C)C1(C2CCC2)C(C)C12C(C)C21CCC1.
What is the InChIKey of 2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane?
The InChIKey is OKPBCVKUPBYAKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28/c1-11(2)16(14-7-5-8-14)13(4)17(16)12(3)15(17)9-6-10-15/h11-14H,5-10H2,1-4H3.
What are the key properties of 2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane?
2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane has a molecular weight of 232.41 g/mol, XLogP of 4.89, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-1,8-dimethyl-2-propan-2-yldispiro[2.0.34.13]octane is sourced from PubChem (CID 59850617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).