2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol

C13H20N2O — CID 73440472

IUPAC2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol
SMILESCc1ccc(C2CCCN(CCO)C2)nc1
InChIInChI=1S/C13H20N2O/c1-11-4-5-13(14-9-11)12-3-2-6-15(10-12)7-8-16/h4-5,9,12,16H,2-3,6-8,10H2,1H3
InChIKeyKQZXWJZCXZNLEG-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.56
Rot. Bonds3

About 2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol

2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol (PubChem CID 73440472) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol.

Molecular Properties

Compound Name2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol
PubChem CID73440472
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol
SMILESCc1ccc(C2CCCN(CCO)C2)nc1
InChIInChI=1S/C13H20N2O/c1-11-4-5-13(14-9-11)12-3-2-6-15(10-12)7-8-16/h4-5,9,12,16H,2-3,6-8,10H2,1H3
InChIKeyKQZXWJZCXZNLEG-UHFFFAOYSA-N
XLogP1.56
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol?
The IUPAC name of 2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol (CID 73440472) is 2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol.
What is the SMILES notation for 2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol?
The canonical SMILES for 2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol is Cc1ccc(C2CCCN(CCO)C2)nc1.
What is the InChIKey of 2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol?
The InChIKey is KQZXWJZCXZNLEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-11-4-5-13(14-9-11)12-3-2-6-15(10-12)7-8-16/h4-5,9,12,16H,2-3,6-8,10H2,1H3.
What are the key properties of 2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol?
2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol has a molecular weight of 220.32 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol is sourced from PubChem (CID 73440472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).