8-propan-2-yl-4-oxaspiro[2.5]octane

C10H18O — CID 176797220

IUPAC8-propan-2-yl-4-oxaspiro[2.5]octane
SMILESCC(C)C1CCCOC12CC2
InChIInChI=1S/C10H18O/c1-8(2)9-4-3-7-11-10(9)5-6-10/h8-9H,3-7H2,1-2H3
InChIKeyCQBOVJMBNMKJIE-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.60
Rot. Bonds1

About 8-propan-2-yl-4-oxaspiro[2.5]octane

8-propan-2-yl-4-oxaspiro[2.5]octane (PubChem CID 176797220) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 8-propan-2-yl-4-oxaspiro[2.5]octane.

Molecular Properties

Compound Name8-propan-2-yl-4-oxaspiro[2.5]octane
PubChem CID176797220
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name8-propan-2-yl-4-oxaspiro[2.5]octane
SMILESCC(C)C1CCCOC12CC2
InChIInChI=1S/C10H18O/c1-8(2)9-4-3-7-11-10(9)5-6-10/h8-9H,3-7H2,1-2H3
InChIKeyCQBOVJMBNMKJIE-UHFFFAOYSA-N
XLogP2.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-propan-2-yl-4-oxaspiro[2.5]octane?
The IUPAC name of 8-propan-2-yl-4-oxaspiro[2.5]octane (CID 176797220) is 8-propan-2-yl-4-oxaspiro[2.5]octane.
What is the SMILES notation for 8-propan-2-yl-4-oxaspiro[2.5]octane?
The canonical SMILES for 8-propan-2-yl-4-oxaspiro[2.5]octane is CC(C)C1CCCOC12CC2.
What is the InChIKey of 8-propan-2-yl-4-oxaspiro[2.5]octane?
The InChIKey is CQBOVJMBNMKJIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-8(2)9-4-3-7-11-10(9)5-6-10/h8-9H,3-7H2,1-2H3.
What are the key properties of 8-propan-2-yl-4-oxaspiro[2.5]octane?
8-propan-2-yl-4-oxaspiro[2.5]octane has a molecular weight of 154.25 g/mol, XLogP of 2.60, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propan-2-yl-4-oxaspiro[2.5]octane is sourced from PubChem (CID 176797220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).