[5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol

C12H12N2O2 — CID 79800019

IUPAC[5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol
SMILESOCc1ccc(OCc2cccnc2)cn1
InChIInChI=1S/C12H12N2O2/c15-8-11-3-4-12(7-14-11)16-9-10-2-1-5-13-6-10/h1-7,15H,8-9H2
InChIKeyAAPIJSLJEVOFJD-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.55
Rot. Bonds4

About [5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol

[5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol (PubChem CID 79800019) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is [5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol
PubChem CID79800019
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name[5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol
SMILESOCc1ccc(OCc2cccnc2)cn1
InChIInChI=1S/C12H12N2O2/c15-8-11-3-4-12(7-14-11)16-9-10-2-1-5-13-6-10/h1-7,15H,8-9H2
InChIKeyAAPIJSLJEVOFJD-UHFFFAOYSA-N
XLogP1.55
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(pyridin-3-ylmethoxy)-2-pyridinyl]methyl]ethanamine
CID 79775715
3-[[4-(pyridin-3-ylmethoxy)phenoxy]methyl]pyridine
CID 91147542
[5-[(3-bromophenyl)methoxy]-2-pyridinyl]methanol
CID 79793730
3-(phenoxymethyl)pyridine;hydrochloride
CID 157085776
3-[[6-(hydroxymethyl)-3-pyridinyl]oxymethyl]benzonitrile
CID 79800273
2-[4-(pyridin-3-ylmethoxy)phenoxy]acetamide
CID 47294468
1-[4-(pyridin-3-ylmethoxy)phenyl]ethanol
CID 43503736
[5-[(3,4-difluorophenyl)methoxy]-2-pyridinyl]methanol
CID 18758409
4-(pyridin-3-ylmethoxy)benzoate
CID 40981209
2-[4-(pyridin-3-ylmethoxy)phenoxy]pyrazine
CID 167789022
[5-(4-phenylbutoxy)-2-pyridinyl]methanol
CID 114333938
trifluoro-[3-(pyridin-3-ylmethoxy)phenyl]boranuide
CID 63678085

Frequently Asked Questions

What is the IUPAC name of [5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol?
The IUPAC name of [5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol (CID 79800019) is [5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol.
What is the SMILES notation for [5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol?
The canonical SMILES for [5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol is OCc1ccc(OCc2cccnc2)cn1.
What is the InChIKey of [5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol?
The InChIKey is AAPIJSLJEVOFJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c15-8-11-3-4-12(7-14-11)16-9-10-2-1-5-13-6-10/h1-7,15H,8-9H2.
What are the key properties of [5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol?
[5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol has a molecular weight of 216.24 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(pyridin-3-ylmethoxy)-2-pyridinyl]methanol is sourced from PubChem (CID 79800019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).