(S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol

C14H15NO2 — CID 94605501

IUPAC(S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol
SMILESCOc1ccc(C)cc1[C@H](O)c1ccccn1
InChIInChI=1S/C14H15NO2/c1-10-6-7-13(17-2)11(9-10)14(16)12-5-3-4-8-15-12/h3-9,14,16H,1-2H3/t14-/m0/s1
InChIKeyLJKOBDOALNOJQD-AWEZNQCLSA-N
MW229.28 g/mol
LogP2.48
Rot. Bonds3

About (S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol

(S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol (PubChem CID 94605501) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is (S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol.

Molecular Properties

Compound Name(S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol
PubChem CID94605501
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name(S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol
SMILESCOc1ccc(C)cc1[C@H](O)c1ccccn1
InChIInChI=1S/C14H15NO2/c1-10-6-7-13(17-2)11(9-10)14(16)12-5-3-4-8-15-12/h3-9,14,16H,1-2H3/t14-/m0/s1
InChIKeyLJKOBDOALNOJQD-AWEZNQCLSA-N
XLogP2.48
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-5-methylphenyl)-2-pyridin-2-ylpropan-1-ol
CID 66459919
1-(2-methoxy-5-methylphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]ethanol
CID 81393339
(2,4-dimethoxyphenyl)-pyridin-2-ylmethanol
CID 62801796
(3,4-dimethoxyphenyl)-pyridin-2-ylmethanol
CID 14098122
(S)-(3-fluoro-4-methoxyphenyl)-pyridin-2-ylmethanol
CID 94605505
(1S)-1-[5-methyl-2-(pyridin-2-ylmethoxy)phenyl]ethanol
CID 55190234
(5-fluoro-2-methoxyphenyl)-(5-methyl-2-pyridinyl)methanol
CID 82770681
dipyridin-2-ylmethanol;palladium(2+);dichloride
CID 173385206
[2-(difluoromethoxy)phenyl]-(2-methoxy-5-methylphenyl)methanol
CID 61081501
1-(2-methoxy-4-methylphenyl)-N-[(1S)-1-pyridin-2-ylethyl]ethanamine
CID 81401623
(2-fluoro-5-methylphenyl)-(2-methoxy-5-methylphenyl)methanol
CID 62509628
(S)-(3,5-dimethylphenyl)-pyridin-2-ylmethanol
CID 1203668

Frequently Asked Questions

What is the IUPAC name of (S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol?
The IUPAC name of (S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol (CID 94605501) is (S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol.
What is the SMILES notation for (S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol?
The canonical SMILES for (S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol is COc1ccc(C)cc1[C@H](O)c1ccccn1.
What is the InChIKey of (S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol?
The InChIKey is LJKOBDOALNOJQD-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H15NO2/c1-10-6-7-13(17-2)11(9-10)14(16)12-5-3-4-8-15-12/h3-9,14,16H,1-2H3/t14-/m0/s1.
What are the key properties of (S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol?
(S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol has a molecular weight of 229.28 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-(2-methoxy-5-methylphenyl)-pyridin-2-ylmethanol is sourced from PubChem (CID 94605501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).