4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol

C14H29NO3 — CID 114229284

IUPAC4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol
SMILESCOC1(C)CCCN(CCC(O)C(C)(C)OC)C1
InChIInChI=1S/C14H29NO3/c1-13(2,17-4)12(16)7-10-15-9-6-8-14(3,11-15)18-5/h12,16H,6-11H2,1-5H3
InChIKeyLYBQOKIHWLDBRL-UHFFFAOYSA-N
MW259.39 g/mol
LogP1.66
Rot. Bonds6

About 4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol

4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol (PubChem CID 114229284) has the molecular formula C14H29NO3 and a molecular weight of 259.39 g/mol. Its IUPAC name is 4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol.

Molecular Properties

Compound Name4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol
PubChem CID114229284
Molecular FormulaC14H29NO3
Molecular Weight259.39 g/mol
Exact Mass259.21
IUPAC Name4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol
SMILESCOC1(C)CCCN(CCC(O)C(C)(C)OC)C1
InChIInChI=1S/C14H29NO3/c1-13(2,17-4)12(16)7-10-15-9-6-8-14(3,11-15)18-5/h12,16H,6-11H2,1-5H3
InChIKeyLYBQOKIHWLDBRL-UHFFFAOYSA-N
XLogP1.66
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,2-dimethylthiomorpholin-4-yl)-4-methoxy-4-methylpentan-3-ol
CID 114229275
2-amino-4-(3-methoxy-3-methylpiperidin-1-yl)butanamide
CID 107394759
1-(3,5-difluorophenyl)-3-(3-methoxy-3-methylpiperidin-1-yl)propan-1-ol
CID 107395261
2-(3-methoxy-3-methylpiperidin-1-yl)ethanethiol
CID 107396245
1-(3-methoxy-3-methylpiperidin-1-yl)-3-methylbutan-2-ol
CID 107394547
2-(ethylamino)-4-(3-methoxy-3-methylpiperidin-1-yl)butanenitrile
CID 107394626
4-(3-methoxy-3-methylpiperidin-1-yl)butan-2-one
CID 107393646
1-amino-5-(3-methoxy-3-methylpiperidin-1-yl)-2-methylpentan-2-ol
CID 107396020
2-(3-methoxy-3-methylpiperidin-1-yl)-N-methylethanamine
CID 107391084
N'-hydroxy-4-(3-methoxy-3-methylpiperidin-1-yl)-2,2-dimethylbutanimidamide
CID 107392865
2-(cyclopropylamino)-4-(3-methoxy-3-methylpiperidin-1-yl)butanamide
CID 107394779
1-(5-bromopentyl)-3-methoxy-3-methylpiperidine
CID 107394409

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol?
The IUPAC name of 4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol (CID 114229284) is 4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol.
What is the SMILES notation for 4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol?
The canonical SMILES for 4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol is COC1(C)CCCN(CCC(O)C(C)(C)OC)C1.
What is the InChIKey of 4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol?
The InChIKey is LYBQOKIHWLDBRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO3/c1-13(2,17-4)12(16)7-10-15-9-6-8-14(3,11-15)18-5/h12,16H,6-11H2,1-5H3.
What are the key properties of 4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol?
4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol has a molecular weight of 259.39 g/mol, XLogP of 1.66, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-3-ol is sourced from PubChem (CID 114229284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).