(2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol

C9H13NO2 — CID 131085993

IUPAC(2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol
SMILESCO[C@@H](C)C(O)c1ccccn1
InChIInChI=1S/C9H13NO2/c1-7(12-2)9(11)8-5-3-4-6-10-8/h3-7,9,11H,1-2H3/t7-,9?/m0/s1
InChIKeyLEEXGSQKBWPTGK-JAVCKPHESA-N
MW167.21 g/mol
LogP1.15
Rot. Bonds3

About (2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol

(2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol (PubChem CID 131085993) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is (2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol.

Molecular Properties

Compound Name(2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol
PubChem CID131085993
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name(2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol
SMILESCO[C@@H](C)C(O)c1ccccn1
InChIInChI=1S/C9H13NO2/c1-7(12-2)9(11)8-5-3-4-6-10-8/h3-7,9,11H,1-2H3/t7-,9?/m0/s1
InChIKeyLEEXGSQKBWPTGK-JAVCKPHESA-N
XLogP1.15
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-2-methyl-1-pyridin-2-ylpropan-1-ol
CID 51670363
(1S,2S)-1-pyridin-2-ylpropane-1,2-diol
CID 28766943
2-methyl-1-pyridin-2-ylbutan-1-ol
CID 79444533
2-amino-3-methyl-1-pyridin-2-ylbutan-1-ol
CID 82280795
(1S)-1-pyridin-2-ylethanol;hydrochloride
CID 71757448
3-methoxy-N-[(1R)-1-pyridin-2-ylethyl]butan-2-amine
CID 104865186
(3S,4R)-4-hydroxy-3-methyl-4-pyridin-2-ylbutan-2-one
CID 130697576
1-(3,5-dimethoxyphenyl)-2-pyridin-2-ylpropan-1-ol
CID 66460720
tert-butyl-[(1R,2S)-2-methoxy-1-pyridin-2-ylpropoxy]-dimethylsilane
CID 10516965
dipyridin-2-ylmethanol;palladium(2+);dichloride
CID 173385206
2-(1-fluoroethyl)pyridine;1-pyridin-2-ylethanol
CID 161183941
1-methoxy-N,N-dimethyl-1-pyridin-2-ylmethanamine
CID 116914548

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol?
The IUPAC name of (2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol (CID 131085993) is (2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol.
What is the SMILES notation for (2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol?
The canonical SMILES for (2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol is CO[C@@H](C)C(O)c1ccccn1.
What is the InChIKey of (2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol?
The InChIKey is LEEXGSQKBWPTGK-JAVCKPHESA-N. The full InChI is InChI=1S/C9H13NO2/c1-7(12-2)9(11)8-5-3-4-6-10-8/h3-7,9,11H,1-2H3/t7-,9?/m0/s1.
What are the key properties of (2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol?
(2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol has a molecular weight of 167.21 g/mol, XLogP of 1.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol is sourced from PubChem (CID 131085993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).