3-methoxy-2-pyridin-3-ylpropan-1-ol

C9H13NO2 — CID 117241293

IUPAC3-methoxy-2-pyridin-3-ylpropan-1-ol
SMILESCOCC(CO)c1cccnc1
InChIInChI=1S/C9H13NO2/c1-12-7-9(6-11)8-3-2-4-10-5-8/h2-5,9,11H,6-7H2,1H3
InChIKeyOTVQZODKRKVKGJ-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.80
Rot. Bonds4

About 3-methoxy-2-pyridin-3-ylpropan-1-ol

3-methoxy-2-pyridin-3-ylpropan-1-ol (PubChem CID 117241293) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is 3-methoxy-2-pyridin-3-ylpropan-1-ol.

Molecular Properties

Compound Name3-methoxy-2-pyridin-3-ylpropan-1-ol
PubChem CID117241293
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name3-methoxy-2-pyridin-3-ylpropan-1-ol
SMILESCOCC(CO)c1cccnc1
InChIInChI=1S/C9H13NO2/c1-12-7-9(6-11)8-3-2-4-10-5-8/h2-5,9,11H,6-7H2,1H3
InChIKeyOTVQZODKRKVKGJ-UHFFFAOYSA-N
XLogP0.80
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-hydroxy-2-pyridin-3-ylpropoxy)phenol
CID 117241268
3-(4-chlorophenoxy)-2-pyridin-3-ylpropan-1-ol
CID 117241285
2-pyridin-3-yl-3-[2-(trifluoromethyl)phenoxy]propan-1-ol
CID 117241260
2,2-dipyridin-3-ylethanol
CID 57450821
2-(3-methylphenyl)-3-pyridin-3-yloxypropan-1-ol
CID 117243147
3-[(3R)-1,4-dimethoxy-3-methylbutyl]pyridine
CID 177219676
2-amino-2-pyridin-3-ylethanol
CID 2734590
2-(dimethylamino)-2-pyridin-3-ylethanol
CID 54775729
2-(4-chlorophenyl)-3-pyridin-3-yloxypropan-1-ol
CID 117245002
3-pyridin-3-ylbutan-1-ol
CID 23506282
3-methoxy-N-[(1S)-1-pyridin-3-ylethyl]propan-1-amine
CID 28673557
3-(methylamino)-3-pyridin-3-ylpropan-1-ol
CID 64815324

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-pyridin-3-ylpropan-1-ol?
The IUPAC name of 3-methoxy-2-pyridin-3-ylpropan-1-ol (CID 117241293) is 3-methoxy-2-pyridin-3-ylpropan-1-ol.
What is the SMILES notation for 3-methoxy-2-pyridin-3-ylpropan-1-ol?
The canonical SMILES for 3-methoxy-2-pyridin-3-ylpropan-1-ol is COCC(CO)c1cccnc1.
What is the InChIKey of 3-methoxy-2-pyridin-3-ylpropan-1-ol?
The InChIKey is OTVQZODKRKVKGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c1-12-7-9(6-11)8-3-2-4-10-5-8/h2-5,9,11H,6-7H2,1H3.
What are the key properties of 3-methoxy-2-pyridin-3-ylpropan-1-ol?
3-methoxy-2-pyridin-3-ylpropan-1-ol has a molecular weight of 167.21 g/mol, XLogP of 0.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-pyridin-3-ylpropan-1-ol is sourced from PubChem (CID 117241293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).