2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol

C14H26O2 — CID 12527840

IUPAC2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol
SMILESCC(C)C1CCC2(CCC(C)(C)O2)C(O)C1
InChIInChI=1S/C14H26O2/c1-10(2)11-5-6-14(12(15)9-11)8-7-13(3,4)16-14/h10-12,15H,5-9H2,1-4H3
InChIKeyIHGMJDWKDLBGGX-UHFFFAOYSA-N
MW226.36 g/mol
LogP3.13
Rot. Bonds1

About 2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol

2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol (PubChem CID 12527840) has the molecular formula C14H26O2 and a molecular weight of 226.36 g/mol. Its IUPAC name is 2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol.

Molecular Properties

Compound Name2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol
PubChem CID12527840
Molecular FormulaC14H26O2
Molecular Weight226.36 g/mol
Exact Mass226.19
IUPAC Name2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol
SMILESCC(C)C1CCC2(CCC(C)(C)O2)C(O)C1
InChIInChI=1S/C14H26O2/c1-10(2)11-5-6-14(12(15)9-11)8-7-13(3,4)16-14/h10-12,15H,5-9H2,1-4H3
InChIKeyIHGMJDWKDLBGGX-UHFFFAOYSA-N
XLogP3.13
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

trans-(2R,4R)-1-methyl-4-propan-2-ylcyclohexane-1,2-diol
CID 54292427
2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol
CID 130150641
(1S,4S,6R)-1-methyl-4-propan-2-yl-7-oxabicyclo[4.1.0]heptane
CID 91751113
(5R)-2-methylidene-5-propan-2-ylcyclohexan-1-ol;(4R)-1-methyl-4-propan-2-yl-7-oxabicyclo[4.1.0]heptane
CID 157385514
2,2-dimethyl-7-propan-2-yl-1-oxaspiro[4.5]decane
CID 118685672
1-methyl-4-propan-2-ylcyclohexan-1-ol;hydrate
CID 141162449
1-methyl-4-propan-2-ylbicyclo[4.1.0]heptane
CID 15579949
1-(1-methyl-4-propan-2-ylcyclohexyl)ethyl acetate
CID 101298084
1-bromo-1-methyl-4-propan-2-ylcyclohexane
CID 90475813
1,1,3-trimethyl-5-propan-2-ylcycloheptane
CID 91452397
(1aS,2R,2aS,4R,6aR,7S)-2,6a-dimethyl-4-propan-2-yl-1a,2a,3,4,5,6,7,7a-octahydronaphtho[2,3-b]oxirene-2,7-diol
CID 134975171
(3R,4aS,5R,8aS)-5,8a-dimethyl-3-propan-2-yl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene
CID 154723915

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol?
The IUPAC name of 2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol (CID 12527840) is 2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol.
What is the SMILES notation for 2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol?
The canonical SMILES for 2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol is CC(C)C1CCC2(CCC(C)(C)O2)C(O)C1.
What is the InChIKey of 2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol?
The InChIKey is IHGMJDWKDLBGGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O2/c1-10(2)11-5-6-14(12(15)9-11)8-7-13(3,4)16-14/h10-12,15H,5-9H2,1-4H3.
What are the key properties of 2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol?
2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol has a molecular weight of 226.36 g/mol, XLogP of 3.13, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol is sourced from PubChem (CID 12527840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).