1-(3,5-dimethylpiperidin-1-yl)butan-2-ol

C11H23NO — CID 60886520

IUPAC1-(3,5-dimethylpiperidin-1-yl)butan-2-ol
SMILESCCC(O)CN1CC(C)CC(C)C1
InChIInChI=1S/C11H23NO/c1-4-11(13)8-12-6-9(2)5-10(3)7-12/h9-11,13H,4-8H2,1-3H3
InChIKeySUKZWBXLMNACRB-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.74
Rot. Bonds3

About 1-(3,5-dimethylpiperidin-1-yl)butan-2-ol

1-(3,5-dimethylpiperidin-1-yl)butan-2-ol (PubChem CID 60886520) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-(3,5-dimethylpiperidin-1-yl)butan-2-ol.

Molecular Properties

Compound Name1-(3,5-dimethylpiperidin-1-yl)butan-2-ol
PubChem CID60886520
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name1-(3,5-dimethylpiperidin-1-yl)butan-2-ol
SMILESCCC(O)CN1CC(C)CC(C)C1
InChIInChI=1S/C11H23NO/c1-4-11(13)8-12-6-9(2)5-10(3)7-12/h9-11,13H,4-8H2,1-3H3
InChIKeySUKZWBXLMNACRB-UHFFFAOYSA-N
XLogP1.74
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.74
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
1-Butylpiperidin-3-ol
CID 98962
1,2,5-Trimethylpiperidin-4-ol
CID 4367834
(2R)-1-(piperidin-1-yl)propan-2-ol
CID 735922
1-(1-Methylpiperidin-4-yl)ethan-1-ol
CID 13266403
1-Propyl-3-piperidinol
CID 15105446
(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

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethylpiperidin-1-yl)butan-2-ol?
The IUPAC name of 1-(3,5-dimethylpiperidin-1-yl)butan-2-ol (CID 60886520) is 1-(3,5-dimethylpiperidin-1-yl)butan-2-ol.
What is the SMILES notation for 1-(3,5-dimethylpiperidin-1-yl)butan-2-ol?
The canonical SMILES for 1-(3,5-dimethylpiperidin-1-yl)butan-2-ol is CCC(O)CN1CC(C)CC(C)C1.
What is the InChIKey of 1-(3,5-dimethylpiperidin-1-yl)butan-2-ol?
The InChIKey is SUKZWBXLMNACRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-4-11(13)8-12-6-9(2)5-10(3)7-12/h9-11,13H,4-8H2,1-3H3.
What are the key properties of 1-(3,5-dimethylpiperidin-1-yl)butan-2-ol?
1-(3,5-dimethylpiperidin-1-yl)butan-2-ol has a molecular weight of 185.31 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethylpiperidin-1-yl)butan-2-ol is sourced from PubChem (CID 60886520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).