[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol

C13H20N2O2 — CID 105066787

IUPAC[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol
SMILESCCOC1CCCN(c2cnccc2CO)C1
InChIInChI=1S/C13H20N2O2/c1-2-17-12-4-3-7-15(9-12)13-8-14-6-5-11(13)10-16/h5-6,8,12,16H,2-4,7,9-10H2,1H3
InChIKeyKSFALVGKDITNJN-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.58
Rot. Bonds4

About [3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol

[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol (PubChem CID 105066787) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is [3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol.

Molecular Properties

Compound Name[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol
PubChem CID105066787
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol
SMILESCCOC1CCCN(c2cnccc2CO)C1
InChIInChI=1S/C13H20N2O2/c1-2-17-12-4-3-7-15(9-12)13-8-14-6-5-11(13)10-16/h5-6,8,12,16H,2-4,7,9-10H2,1H3
InChIKeyKSFALVGKDITNJN-UHFFFAOYSA-N
XLogP1.58
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine
CID 105073708
N-[[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methyl]propan-1-amine
CID 105073711
N-[[4-(3-ethoxypiperidin-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 81247761
[3-(3,4-dimethylpyrrolidin-1-yl)-4-pyridinyl]methanol
CID 105066909
[3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-4-pyridinyl]methanol
CID 105066917
[1-[4-(hydroxymethyl)-3-pyridinyl]-3-methylpyrrolidin-2-yl]methanol
CID 102787683
2-(3-ethoxypiperidin-1-yl)benzaldehyde
CID 54990320
1-[3-chloro-2-(chloromethyl)phenyl]-3-ethoxypiperidine
CID 54989891
2-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanamine
CID 63787234
(1R)-1-[2-(3-ethoxypiperidin-1-yl)phenyl]ethanol
CID 55183213
1-[3-chloro-4-(3-ethoxypiperidin-1-yl)phenyl]ethanol
CID 62910229
N-[[3-(3-ethylpiperidin-1-yl)-4-pyridinyl]methyl]cyclopropanamine
CID 105073026

Frequently Asked Questions

What is the IUPAC name of [3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol?
The IUPAC name of [3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol (CID 105066787) is [3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol.
What is the SMILES notation for [3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol?
The canonical SMILES for [3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol is CCOC1CCCN(c2cnccc2CO)C1.
What is the InChIKey of [3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol?
The InChIKey is KSFALVGKDITNJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-2-17-12-4-3-7-15(9-12)13-8-14-6-5-11(13)10-16/h5-6,8,12,16H,2-4,7,9-10H2,1H3.
What are the key properties of [3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol?
[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol has a molecular weight of 236.31 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol is sourced from PubChem (CID 105066787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).