2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol

C14H22N2O2 — CID 82982184

IUPAC2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol
SMILESCCOC1CCN(Cc2nc(C)ccc2O)CC1
InChIInChI=1S/C14H22N2O2/c1-3-18-12-6-8-16(9-7-12)10-13-14(17)5-4-11(2)15-13/h4-5,12,17H,3,6-10H2,1-2H3
InChIKeyPXLCXEDVKSHIIM-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.10
Rot. Bonds4

About 2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol

2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol (PubChem CID 82982184) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol.

Molecular Properties

Compound Name2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol
PubChem CID82982184
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol
SMILESCCOC1CCN(Cc2nc(C)ccc2O)CC1
InChIInChI=1S/C14H22N2O2/c1-3-18-12-6-8-16(9-7-12)10-13-14(17)5-4-11(2)15-13/h4-5,12,17H,3,6-10H2,1-2H3
InChIKeyPXLCXEDVKSHIIM-UHFFFAOYSA-N
XLogP2.10
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol?
The IUPAC name of 2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol (CID 82982184) is 2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol.
What is the SMILES notation for 2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol?
The canonical SMILES for 2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol is CCOC1CCN(Cc2nc(C)ccc2O)CC1.
What is the InChIKey of 2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol?
The InChIKey is PXLCXEDVKSHIIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-3-18-12-6-8-16(9-7-12)10-13-14(17)5-4-11(2)15-13/h4-5,12,17H,3,6-10H2,1-2H3.
What are the key properties of 2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol?
2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol has a molecular weight of 250.34 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethoxypiperidin-1-yl)methyl]-6-methylpyridin-3-ol is sourced from PubChem (CID 82982184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).