2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol

C18H35NO2 — CID 114622678

IUPAC2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol
SMILESCCC(C)(C(O)C1CC(C)(C)OC1(C)C)N1CCCCC1
InChIInChI=1S/C18H35NO2/c1-7-18(6,19-11-9-8-10-12-19)15(20)14-13-16(2,3)21-17(14,4)5/h14-15,20H,7-13H2,1-6H3
InChIKeyYDOINPQDLBFILR-UHFFFAOYSA-N
MW297.48 g/mol
LogP3.60
Rot. Bonds4

About 2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol

2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol (PubChem CID 114622678) has the molecular formula C18H35NO2 and a molecular weight of 297.48 g/mol. Its IUPAC name is 2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol.

Molecular Properties

Compound Name2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol
PubChem CID114622678
Molecular FormulaC18H35NO2
Molecular Weight297.48 g/mol
Exact Mass297.27
IUPAC Name2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol
SMILESCCC(C)(C(O)C1CC(C)(C)OC1(C)C)N1CCCCC1
InChIInChI=1S/C18H35NO2/c1-7-18(6,19-11-9-8-10-12-19)15(20)14-13-16(2,3)21-17(14,4)5/h14-15,20H,7-13H2,1-6H3
InChIKeyYDOINPQDLBFILR-UHFFFAOYSA-N
XLogP3.60
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.48
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol with MolForge

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Related Compounds

2-methyl-2-morpholin-4-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)propan-1-ol
CID 114622674
1-cycloheptyl-2-methyl-2-pyrrolidin-1-ylbutan-1-ol
CID 82931304
2-methyl-1-(oxan-4-yl)-2-piperidin-1-ylbutan-1-ol
CID 79065730
3,3-dimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol
CID 114622056
2-methyl-1-(3-methylcyclohexyl)-2-piperidin-1-ylbutan-1-ol
CID 79064908
1-cyclohexyl-2-methyl-2-morpholin-4-ylbutan-1-ol
CID 79065772
1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-methyl-2-pyrrolidin-1-ylbutan-1-ol
CID 79910779
3,5-dimethyl-3-piperidin-1-ylheptan-4-ol
CID 79445766
1-cyclobutyl-3-methyl-3-piperidin-1-ylpentan-2-ol
CID 79065510
1-(2,2,5,5-tetramethyloxolan-3-yl)decan-1-ol
CID 115838780
2-(tert-butylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol
CID 114624352
1-N,2-N,2-N,2-tetramethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)butane-1,2-diamine
CID 114623234

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol?
The IUPAC name of 2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol (CID 114622678) is 2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol.
What is the SMILES notation for 2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol?
The canonical SMILES for 2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol is CCC(C)(C(O)C1CC(C)(C)OC1(C)C)N1CCCCC1.
What is the InChIKey of 2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol?
The InChIKey is YDOINPQDLBFILR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO2/c1-7-18(6,19-11-9-8-10-12-19)15(20)14-13-16(2,3)21-17(14,4)5/h14-15,20H,7-13H2,1-6H3.
What are the key properties of 2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol?
2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol has a molecular weight of 297.48 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-piperidin-1-yl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol is sourced from PubChem (CID 114622678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).