1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol

C12H25NO2 — CID 102966089

IUPAC1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol
SMILESCOC1CCCN(CC(O)C(C)(C)C)C1
InChIInChI=1S/C12H25NO2/c1-12(2,3)11(14)9-13-7-5-6-10(8-13)15-4/h10-11,14H,5-9H2,1-4H3
InChIKeyKXYGNJSMDOFWEO-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.50
Rot. Bonds3

About 1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol

1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol (PubChem CID 102966089) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol.

Molecular Properties

Compound Name1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol
PubChem CID102966089
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol
SMILESCOC1CCCN(CC(O)C(C)(C)C)C1
InChIInChI=1S/C12H25NO2/c1-12(2,3)11(14)9-13-7-5-6-10(8-13)15-4/h10-11,14H,5-9H2,1-4H3
InChIKeyKXYGNJSMDOFWEO-UHFFFAOYSA-N
XLogP1.50
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-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

1-(3-methoxypyrrolidin-1-yl)-4,4-dimethylpentan-3-ol
CID 103539229
2-amino-3-(3-methoxypiperidin-1-yl)propan-1-ol
CID 102968945
2-methoxy-3-(3-methoxypiperidin-1-yl)propan-1-amine
CID 106115075
3-(3-methoxypiperidin-1-yl)-2-methylpropanethioamide
CID 102958133
3-(3-methoxypiperidin-1-yl)-2-(propan-2-ylamino)propan-1-ol
CID 102968981
1-(3-methoxypyrrolidin-1-yl)pentan-2-ol
CID 103537643
5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine
CID 102963876
2-[(3-methoxypiperidin-1-yl)methyl]-2-methylbutan-1-ol
CID 102967560
1-(3-methoxypiperidin-1-yl)-N-methylpentan-2-amine
CID 102965544
1-(4-amino-3,5-dimethylpyrazol-1-yl)-3-(3-methoxypiperidin-1-yl)propan-2-ol
CID 102956428
3,3,3-trifluoro-2-[(3-methoxypiperidin-1-yl)methyl]propanimidamide
CID 103370849
(2S)-1-(4-methoxyazepan-1-yl)propan-2-ol
CID 164647914

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol?
The IUPAC name of 1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol (CID 102966089) is 1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol.
What is the SMILES notation for 1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol?
The canonical SMILES for 1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol is COC1CCCN(CC(O)C(C)(C)C)C1.
What is the InChIKey of 1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol?
The InChIKey is KXYGNJSMDOFWEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-12(2,3)11(14)9-13-7-5-6-10(8-13)15-4/h10-11,14H,5-9H2,1-4H3.
What are the key properties of 1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol?
1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol has a molecular weight of 215.34 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol is sourced from PubChem (CID 102966089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).