2-(3,5-dimethylpiperidin-1-yl)ethanol

C9H19NO — CID 43394133

IUPAC2-(3,5-dimethylpiperidin-1-yl)ethanol
SMILESCC1CC(C)CN(CCO)C1
InChIInChI=1S/C9H19NO/c1-8-5-9(2)7-10(6-8)3-4-11/h8-9,11H,3-7H2,1-2H3
InChIKeyOXTCNSACQOVPQK-UHFFFAOYSA-N
MW157.26 g/mol
LogP0.96
Rot. Bonds2

About 2-(3,5-dimethylpiperidin-1-yl)ethanol

2-(3,5-dimethylpiperidin-1-yl)ethanol (PubChem CID 43394133) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 2-(3,5-dimethylpiperidin-1-yl)ethanol.

Molecular Properties

Compound Name2-(3,5-dimethylpiperidin-1-yl)ethanol
PubChem CID43394133
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name2-(3,5-dimethylpiperidin-1-yl)ethanol
SMILESCC1CC(C)CN(CCO)C1
InChIInChI=1S/C9H19NO/c1-8-5-9(2)7-10(6-8)3-4-11/h8-9,11H,3-7H2,1-2H3
InChIKeyOXTCNSACQOVPQK-UHFFFAOYSA-N
XLogP0.96
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 ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-methylpyrrolidin-1-yl)ethanol
CID 22706983
2-[3-(2,2-difluoroethylamino)-5-methylpiperidin-1-yl]ethanol
CID 83993383
4-(3-methylazetidin-1-yl)butan-1-ol
CID 106844124
2-(6-methyl-3,6-diazabicyclo[3.1.1]heptan-3-yl)ethanol
CID 84763750
3-(3,5-dimethylpiperidin-1-yl)-N'-hydroxypropanimidamide
CID 24694035
1-(9-bromononyl)-3,5-dimethylpiperidine
CID 105343565
6-(3,5-dimethylpiperidin-1-yl)hexan-3-one
CID 106801147
4-(3,5-dimethylpiperidin-1-yl)-2,2-dimethylbutanimidamide
CID 65250505
4-(2-hydroxyethyl)-2,6-dimethylpiperazine-1-carboxylic acid
CID 67211888
2-(3,5-dimethyl-4-nitrosopiperazin-1-yl)ethanol
CID 87376207
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]acetamide
CID 70842274
2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]cyclopentan-1-ol
CID 79577432

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpiperidin-1-yl)ethanol?
The IUPAC name of 2-(3,5-dimethylpiperidin-1-yl)ethanol (CID 43394133) is 2-(3,5-dimethylpiperidin-1-yl)ethanol.
What is the SMILES notation for 2-(3,5-dimethylpiperidin-1-yl)ethanol?
The canonical SMILES for 2-(3,5-dimethylpiperidin-1-yl)ethanol is CC1CC(C)CN(CCO)C1.
What is the InChIKey of 2-(3,5-dimethylpiperidin-1-yl)ethanol?
The InChIKey is OXTCNSACQOVPQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-8-5-9(2)7-10(6-8)3-4-11/h8-9,11H,3-7H2,1-2H3.
What are the key properties of 2-(3,5-dimethylpiperidin-1-yl)ethanol?
2-(3,5-dimethylpiperidin-1-yl)ethanol has a molecular weight of 157.26 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpiperidin-1-yl)ethanol is sourced from PubChem (CID 43394133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).