1,3-dimethylpiperidin-4-ol;methanol

C8H19NO2 — CID 91104408

IUPAC1,3-dimethylpiperidin-4-ol;methanol
SMILESCC1CN(C)CCC1O.CO
InChIInChI=1S/C7H15NO.CH4O/c1-6-5-8(2)4-3-7(6)9;1-2/h6-7,9H,3-5H2,1-2H3;2H,1H3
InChIKeyGVPJYDVZISAULA-UHFFFAOYSA-N
MW161.25 g/mol
LogP-0.07
Rot. Bonds

About 1,3-dimethylpiperidin-4-ol;methanol

1,3-dimethylpiperidin-4-ol;methanol (PubChem CID 91104408) has the molecular formula C8H19NO2 and a molecular weight of 161.25 g/mol. Its IUPAC name is 1,3-dimethylpiperidin-4-ol;methanol.

Molecular Properties

Compound Name1,3-dimethylpiperidin-4-ol;methanol
PubChem CID91104408
Molecular FormulaC8H19NO2
Molecular Weight161.25 g/mol
Exact Mass161.14
IUPAC Name1,3-dimethylpiperidin-4-ol;methanol
SMILESCC1CN(C)CCC1O.CO
InChIInChI=1S/C7H15NO.CH4O/c1-6-5-8(2)4-3-7(6)9;1-2/h6-7,9H,3-5H2,1-2H3;2H,1H3
InChIKeyGVPJYDVZISAULA-UHFFFAOYSA-N
XLogP-0.07
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-Propylpiperidin-4-ol
CID 13665269
1-(1-Ethylpiperidin-4-yl)ethan-1-ol
CID 588327
1,2,5-Trimethylpiperidin-4-ol
CID 4367834
1-(1-Methylpiperidin-4-yl)ethan-1-ol
CID 13266403
1-(1-Propylpiperidin-3-yl)ethan-1-ol
CID 21317077
1-tert-Butylpiperidin-4-ol
CID 22647882
(1S)-1-(1,1-dimethylpiperidin-1-ium-4-yl)ethanol
CID 44368116
3-Hydroxymethyl-N,N-dimethylpiperidinium
CID 194499
4-Hydroxy-N,N-dimethylpiperidinium
CID 428683
1-t-Butyl-3-methyl-4-hydroxypiperidine
CID 3613566
1,3,5-Trimethylpiperidin-4-ol
CID 91446778
1-(2-Methylpropyl)piperidin-4-ol
CID 12725714

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethylpiperidin-4-ol;methanol?
The IUPAC name of 1,3-dimethylpiperidin-4-ol;methanol (CID 91104408) is 1,3-dimethylpiperidin-4-ol;methanol.
What is the SMILES notation for 1,3-dimethylpiperidin-4-ol;methanol?
The canonical SMILES for 1,3-dimethylpiperidin-4-ol;methanol is CC1CN(C)CCC1O.CO.
What is the InChIKey of 1,3-dimethylpiperidin-4-ol;methanol?
The InChIKey is GVPJYDVZISAULA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.CH4O/c1-6-5-8(2)4-3-7(6)9;1-2/h6-7,9H,3-5H2,1-2H3;2H,1H3.
What are the key properties of 1,3-dimethylpiperidin-4-ol;methanol?
1,3-dimethylpiperidin-4-ol;methanol has a molecular weight of 161.25 g/mol, XLogP of -0.07, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethylpiperidin-4-ol;methanol is sourced from PubChem (CID 91104408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).