2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol

C16H30O2 — CID 102902006

IUPAC2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol
SMILESCCC(CC)(CO)CC1CCC2(CCCCC2)O1
InChIInChI=1S/C16H30O2/c1-3-15(4-2,13-17)12-14-8-11-16(18-14)9-6-5-7-10-16/h14,17H,3-13H2,1-2H3
InChIKeyCKVFADMPXXDVQM-UHFFFAOYSA-N
MW254.41 g/mol
LogP4.06
Rot. Bonds5

About 2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol

2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol (PubChem CID 102902006) has the molecular formula C16H30O2 and a molecular weight of 254.41 g/mol. Its IUPAC name is 2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol.

Molecular Properties

Compound Name2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol
PubChem CID102902006
Molecular FormulaC16H30O2
Molecular Weight254.41 g/mol
Exact Mass254.22
IUPAC Name2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol
SMILESCCC(CC)(CO)CC1CCC2(CCCCC2)O1
InChIInChI=1S/C16H30O2/c1-3-15(4-2,13-17)12-14-8-11-16(18-14)9-6-5-7-10-16/h14,17H,3-13H2,1-2H3
InChIKeyCKVFADMPXXDVQM-UHFFFAOYSA-N
XLogP4.06
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.41
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-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

2-[(5,5-dimethyloxolan-2-yl)methyl]-2-ethylbutan-1-ol
CID 116525112
2-methyl-2-(1-oxaspiro[4.4]nonan-2-ylmethyl)propane-1,3-diol
CID 102902443
2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)propane-1,3-diol
CID 107865527
2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethylamino)propane-1,3-diol
CID 107865302
2-(3-chloro-2,2-dimethylpropyl)-1-oxaspiro[4.5]decane
CID 102902077
N-ethyl-2-methyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-amine
CID 102900369
2-(chloromethyl)-2-ethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-amine
CID 106252571
ethyl 2-(aminomethyl)-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butanoate
CID 106487561
2-methyl-4-(1-oxaspiro[4.5]decan-2-yl)butan-1-ol
CID 102901406
2-methyl-2-(1-oxaspiro[4.4]nonan-2-ylmethylamino)propane-1,3-diol
CID 102897666
2-butyl-1-oxaspiro[4.5]decane
CID 154513555
tert-butyl N-[2-(hydroxymethyl)-2-methyl-3-(1-oxaspiro[4.4]nonan-2-yl)propyl]carbamate
CID 106508716

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol?
The IUPAC name of 2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol (CID 102902006) is 2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol.
What is the SMILES notation for 2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol?
The canonical SMILES for 2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol is CCC(CC)(CO)CC1CCC2(CCCCC2)O1.
What is the InChIKey of 2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol?
The InChIKey is CKVFADMPXXDVQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30O2/c1-3-15(4-2,13-17)12-14-8-11-16(18-14)9-6-5-7-10-16/h14,17H,3-13H2,1-2H3.
What are the key properties of 2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol?
2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol has a molecular weight of 254.41 g/mol, XLogP of 4.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol is sourced from PubChem (CID 102902006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).