(S)-(4-methoxyphenyl)-pyridin-2-ylmethanol

C13H13NO2 — CID 3246512

IUPAC(S)-(4-methoxyphenyl)-pyridin-2-ylmethanol
SMILESCOc1ccc([C@H](O)c2ccccn2)cc1
InChIInChI=1S/C13H13NO2/c1-16-11-7-5-10(6-8-11)13(15)12-4-2-3-9-14-12/h2-9,13,15H,1H3/t13-/m0/s1
InChIKeyOQFKODRWEHYZQP-ZDUSSCGKSA-N
MW215.25 g/mol
LogP2.17
Rot. Bonds3

About (S)-(4-methoxyphenyl)-pyridin-2-ylmethanol

(S)-(4-methoxyphenyl)-pyridin-2-ylmethanol (PubChem CID 3246512) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is (S)-(4-methoxyphenyl)-pyridin-2-ylmethanol.

Molecular Properties

Compound Name(S)-(4-methoxyphenyl)-pyridin-2-ylmethanol
PubChem CID3246512
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC Name(S)-(4-methoxyphenyl)-pyridin-2-ylmethanol
SMILESCOc1ccc([C@H](O)c2ccccn2)cc1
InChIInChI=1S/C13H13NO2/c1-16-11-7-5-10(6-8-11)13(15)12-4-2-3-9-14-12/h2-9,13,15H,1H3/t13-/m0/s1
InChIKeyOQFKODRWEHYZQP-ZDUSSCGKSA-N
XLogP2.17
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 ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (S)-(4-methoxyphenyl)-pyridin-2-ylmethanol?
The IUPAC name of (S)-(4-methoxyphenyl)-pyridin-2-ylmethanol (CID 3246512) is (S)-(4-methoxyphenyl)-pyridin-2-ylmethanol.
What is the SMILES notation for (S)-(4-methoxyphenyl)-pyridin-2-ylmethanol?
The canonical SMILES for (S)-(4-methoxyphenyl)-pyridin-2-ylmethanol is COc1ccc([C@H](O)c2ccccn2)cc1.
What is the InChIKey of (S)-(4-methoxyphenyl)-pyridin-2-ylmethanol?
The InChIKey is OQFKODRWEHYZQP-ZDUSSCGKSA-N. The full InChI is InChI=1S/C13H13NO2/c1-16-11-7-5-10(6-8-11)13(15)12-4-2-3-9-14-12/h2-9,13,15H,1H3/t13-/m0/s1.
What are the key properties of (S)-(4-methoxyphenyl)-pyridin-2-ylmethanol?
(S)-(4-methoxyphenyl)-pyridin-2-ylmethanol has a molecular weight of 215.25 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-(4-methoxyphenyl)-pyridin-2-ylmethanol is sourced from PubChem (CID 3246512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).