(3-methyl-4-pyridin-3-yloxyphenyl)methanol

C13H13NO2 — CID 62124917

IUPAC(3-methyl-4-pyridin-3-yloxyphenyl)methanol
SMILESCc1cc(CO)ccc1Oc1cccnc1
InChIInChI=1S/C13H13NO2/c1-10-7-11(9-15)4-5-13(10)16-12-3-2-6-14-8-12/h2-8,15H,9H2,1H3
InChIKeyWDQSJWBUKOIYJE-UHFFFAOYSA-N
MW215.25 g/mol
LogP2.67
Rot. Bonds3

About (3-methyl-4-pyridin-3-yloxyphenyl)methanol

(3-methyl-4-pyridin-3-yloxyphenyl)methanol (PubChem CID 62124917) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is (3-methyl-4-pyridin-3-yloxyphenyl)methanol.

Molecular Properties

Compound Name(3-methyl-4-pyridin-3-yloxyphenyl)methanol
PubChem CID62124917
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC Name(3-methyl-4-pyridin-3-yloxyphenyl)methanol
SMILESCc1cc(CO)ccc1Oc1cccnc1
InChIInChI=1S/C13H13NO2/c1-10-7-11(9-15)4-5-13(10)16-12-3-2-6-14-8-12/h2-8,15H,9H2,1H3
InChIKeyWDQSJWBUKOIYJE-UHFFFAOYSA-N
XLogP2.67
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-methyl-4-pyridin-3-yloxyphenyl)methanol?
The IUPAC name of (3-methyl-4-pyridin-3-yloxyphenyl)methanol (CID 62124917) is (3-methyl-4-pyridin-3-yloxyphenyl)methanol.
What is the SMILES notation for (3-methyl-4-pyridin-3-yloxyphenyl)methanol?
The canonical SMILES for (3-methyl-4-pyridin-3-yloxyphenyl)methanol is Cc1cc(CO)ccc1Oc1cccnc1.
What is the InChIKey of (3-methyl-4-pyridin-3-yloxyphenyl)methanol?
The InChIKey is WDQSJWBUKOIYJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2/c1-10-7-11(9-15)4-5-13(10)16-12-3-2-6-14-8-12/h2-8,15H,9H2,1H3.
What are the key properties of (3-methyl-4-pyridin-3-yloxyphenyl)methanol?
(3-methyl-4-pyridin-3-yloxyphenyl)methanol has a molecular weight of 215.25 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-4-pyridin-3-yloxyphenyl)methanol is sourced from PubChem (CID 62124917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).