1-(3-methylpiperidin-1-yl)propan-2-ol

C9H19NO — CID 60886125

IUPAC1-(3-methylpiperidin-1-yl)propan-2-ol
SMILESCC(O)CN1CCCC(C)C1
InChIInChI=1S/C9H19NO/c1-8-4-3-5-10(6-8)7-9(2)11/h8-9,11H,3-7H2,1-2H3
InChIKeyXLQIJBYNFYSSBT-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.10
Rot. Bonds2

About 1-(3-methylpiperidin-1-yl)propan-2-ol

1-(3-methylpiperidin-1-yl)propan-2-ol (PubChem CID 60886125) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 1-(3-methylpiperidin-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-(3-methylpiperidin-1-yl)propan-2-ol
PubChem CID60886125
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name1-(3-methylpiperidin-1-yl)propan-2-ol
SMILESCC(O)CN1CCCC(C)C1
InChIInChI=1S/C9H19NO/c1-8-4-3-5-10(6-8)7-9(2)11/h8-9,11H,3-7H2,1-2H3
InChIKeyXLQIJBYNFYSSBT-UHFFFAOYSA-N
XLogP1.10
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Amino-3-(3-methylpiperidin-1-yl)propan-2-ol
CID 3161650
alpha-Methyl-1-piperidineethanol
CID 233605
(2S)-1-(piperidin-1-yl)propan-2-ol
CID 735921
1-(1-Ethylpiperidin-4-yl)ethan-1-ol
CID 588327
Octapinol
CID 68906
1-Piperidineethanol, 5-ethyl-2-methyl-
CID 205792
(2R)-1-(piperidin-1-yl)propan-2-ol
CID 735922
1-(1-Methylpiperidin-4-yl)ethan-1-ol
CID 13266403
(1S)-1-(1,1-dimethylpiperidin-1-ium-4-yl)ethanol
CID 44368116
1-t-Butyl-3-methyl-4-hydroxypiperidine
CID 3613566
trans-1,4-Dimethylpiperidin-3-ol
CID 537403
1-Tert-butyl-4-methylpiperidin-3-ol
CID 5301330

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylpiperidin-1-yl)propan-2-ol?
The IUPAC name of 1-(3-methylpiperidin-1-yl)propan-2-ol (CID 60886125) is 1-(3-methylpiperidin-1-yl)propan-2-ol.
What is the SMILES notation for 1-(3-methylpiperidin-1-yl)propan-2-ol?
The canonical SMILES for 1-(3-methylpiperidin-1-yl)propan-2-ol is CC(O)CN1CCCC(C)C1.
What is the InChIKey of 1-(3-methylpiperidin-1-yl)propan-2-ol?
The InChIKey is XLQIJBYNFYSSBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-8-4-3-5-10(6-8)7-9(2)11/h8-9,11H,3-7H2,1-2H3.
What are the key properties of 1-(3-methylpiperidin-1-yl)propan-2-ol?
1-(3-methylpiperidin-1-yl)propan-2-ol has a molecular weight of 157.26 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylpiperidin-1-yl)propan-2-ol is sourced from PubChem (CID 60886125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).