2-methyl-1-oxaspiro[4.5]decan-6-ol

C10H18O2 — CID 22395766

IUPAC2-methyl-1-oxaspiro[4.5]decan-6-ol
SMILESCC1CCC2(CCCCC2O)O1
InChIInChI=1S/C10H18O2/c1-8-5-7-10(12-8)6-3-2-4-9(10)11/h8-9,11H,2-7H2,1H3
InChIKeyBPVOJYJKQHMXKD-UHFFFAOYSA-N
MW170.25 g/mol
LogP1.86
Rot. Bonds

About 2-methyl-1-oxaspiro[4.5]decan-6-ol

2-methyl-1-oxaspiro[4.5]decan-6-ol (PubChem CID 22395766) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 2-methyl-1-oxaspiro[4.5]decan-6-ol.

Molecular Properties

Compound Name2-methyl-1-oxaspiro[4.5]decan-6-ol
PubChem CID22395766
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name2-methyl-1-oxaspiro[4.5]decan-6-ol
SMILESCC1CCC2(CCCCC2O)O1
InChIInChI=1S/C10H18O2/c1-8-5-7-10(12-8)6-3-2-4-9(10)11/h8-9,11H,2-7H2,1H3
InChIKeyBPVOJYJKQHMXKD-UHFFFAOYSA-N
XLogP1.86
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-oxaspiro[4.5]decan-6-ol?
The IUPAC name of 2-methyl-1-oxaspiro[4.5]decan-6-ol (CID 22395766) is 2-methyl-1-oxaspiro[4.5]decan-6-ol.
What is the SMILES notation for 2-methyl-1-oxaspiro[4.5]decan-6-ol?
The canonical SMILES for 2-methyl-1-oxaspiro[4.5]decan-6-ol is CC1CCC2(CCCCC2O)O1.
What is the InChIKey of 2-methyl-1-oxaspiro[4.5]decan-6-ol?
The InChIKey is BPVOJYJKQHMXKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-8-5-7-10(12-8)6-3-2-4-9(10)11/h8-9,11H,2-7H2,1H3.
What are the key properties of 2-methyl-1-oxaspiro[4.5]decan-6-ol?
2-methyl-1-oxaspiro[4.5]decan-6-ol has a molecular weight of 170.25 g/mol, XLogP of 1.86, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-oxaspiro[4.5]decan-6-ol is sourced from PubChem (CID 22395766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).