1-piperidin-3-yl-1-pyridin-3-ylethanol

C12H18N2O — CID 63585901

IUPAC1-piperidin-3-yl-1-pyridin-3-ylethanol
SMILESCC(O)(c1cccnc1)C1CCCNC1
InChIInChI=1S/C12H18N2O/c1-12(15,10-4-2-6-13-8-10)11-5-3-7-14-9-11/h2,4,6,8,11,14-15H,3,5,7,9H2,1H3
InChIKeyGBTOTHJSRBJMRA-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.29
Rot. Bonds2

About 1-piperidin-3-yl-1-pyridin-3-ylethanol

1-piperidin-3-yl-1-pyridin-3-ylethanol (PubChem CID 63585901) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 1-piperidin-3-yl-1-pyridin-3-ylethanol.

Molecular Properties

Compound Name1-piperidin-3-yl-1-pyridin-3-ylethanol
PubChem CID63585901
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name1-piperidin-3-yl-1-pyridin-3-ylethanol
SMILESCC(O)(c1cccnc1)C1CCCNC1
InChIInChI=1S/C12H18N2O/c1-12(15,10-4-2-6-13-8-10)11-5-3-7-14-9-11/h2,4,6,8,11,14-15H,3,5,7,9H2,1H3
InChIKeyGBTOTHJSRBJMRA-UHFFFAOYSA-N
XLogP1.29
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-tert-butylphenyl)-1-piperidin-3-ylethanol
CID 63586623
1-(4-aminophenyl)-1-piperidin-3-ylethanol
CID 115032208
[3-methyl-4-(1-piperidin-3-yl-1-pyridin-3-ylethoxy)-1-benzofuran-2-yl]methanol
CID 70220319
1-(4-cyclobutylphenyl)-1-piperidin-3-ylethanol
CID 116505257
3-(2-cyclohexylpropan-2-yl)pyridine
CID 91076672
dicyclohexyl(pyridin-3-yl)methanol
CID 70631118
N-methyl-N-piperidin-3-ylpyridin-3-amine
CID 83698004
2-methyl-2-pyridin-3-yl-N-(pyrrolidin-3-ylmethyl)propan-1-amine
CID 115209149
1-(2,5-dimethylphenyl)-1-piperidin-3-ylethanol
CID 63586450
cyclohexyl-phenyl-piperidin-3-ylmethanol
CID 23966017
tripyridin-3-ylmethanol
CID 177395677
1-(3-fluoro-4-pyridinyl)-2-methyl-2-piperidin-3-ylpropan-1-one
CID 116611168

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-3-yl-1-pyridin-3-ylethanol?
The IUPAC name of 1-piperidin-3-yl-1-pyridin-3-ylethanol (CID 63585901) is 1-piperidin-3-yl-1-pyridin-3-ylethanol.
What is the SMILES notation for 1-piperidin-3-yl-1-pyridin-3-ylethanol?
The canonical SMILES for 1-piperidin-3-yl-1-pyridin-3-ylethanol is CC(O)(c1cccnc1)C1CCCNC1.
What is the InChIKey of 1-piperidin-3-yl-1-pyridin-3-ylethanol?
The InChIKey is GBTOTHJSRBJMRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-12(15,10-4-2-6-13-8-10)11-5-3-7-14-9-11/h2,4,6,8,11,14-15H,3,5,7,9H2,1H3.
What are the key properties of 1-piperidin-3-yl-1-pyridin-3-ylethanol?
1-piperidin-3-yl-1-pyridin-3-ylethanol has a molecular weight of 206.29 g/mol, XLogP of 1.29, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-3-yl-1-pyridin-3-ylethanol is sourced from PubChem (CID 63585901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).