1-(5-methoxy-2-pyridinyl)propan-2-ol

C9H13NO2 — CID 83675700

IUPAC1-(5-methoxy-2-pyridinyl)propan-2-ol
SMILESCOc1ccc(CC(C)O)nc1
InChIInChI=1S/C9H13NO2/c1-7(11)5-8-3-4-9(12-2)6-10-8/h3-4,6-7,11H,5H2,1-2H3
InChIKeyMIRCUILOTWXUMV-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.01
Rot. Bonds3

About 1-(5-methoxy-2-pyridinyl)propan-2-ol

1-(5-methoxy-2-pyridinyl)propan-2-ol (PubChem CID 83675700) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is 1-(5-methoxy-2-pyridinyl)propan-2-ol.

Molecular Properties

Compound Name1-(5-methoxy-2-pyridinyl)propan-2-ol
PubChem CID83675700
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name1-(5-methoxy-2-pyridinyl)propan-2-ol
SMILESCOc1ccc(CC(C)O)nc1
InChIInChI=1S/C9H13NO2/c1-7(11)5-8-3-4-9(12-2)6-10-8/h3-4,6-7,11H,5H2,1-2H3
InChIKeyMIRCUILOTWXUMV-UHFFFAOYSA-N
XLogP1.01
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 ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(2-hydroxypropyl)pyridine-3-carboxylic acid
CID 68757151
5-methoxy-2-propylpyridine
CID 129127600
(5-methoxy-2-pyridinyl)methyl-triphenylphosphanium chloride
CID 22678705
1-(5-ethyl-2-pyridinyl)-4-(4-methoxyphenyl)butan-2-ol
CID 115822379
2-(5-methoxy-2-pyridinyl)ethanamine;hydrochloride
CID 86280253
2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]acetamide
CID 79800080
1-[5-[1-(4-aminopyrazol-1-yl)ethyl]-2-pyridinyl]propan-2-ol
CID 175973967
(2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol
CID 97009148
(2R)-1-(2,4-dimethoxyphenyl)propan-2-ol
CID 75406786
(2R)-1-(5-methoxy-2-methylphenyl)propan-2-ol
CID 68649923
2-[[6-(2-aminopropyl)-3-pyridinyl]oxy]propanamide
CID 79796082
1-(5-butan-2-yloxy-2-pyridinyl)propan-2-amine
CID 79799813

Frequently Asked Questions

What is the IUPAC name of 1-(5-methoxy-2-pyridinyl)propan-2-ol?
The IUPAC name of 1-(5-methoxy-2-pyridinyl)propan-2-ol (CID 83675700) is 1-(5-methoxy-2-pyridinyl)propan-2-ol.
What is the SMILES notation for 1-(5-methoxy-2-pyridinyl)propan-2-ol?
The canonical SMILES for 1-(5-methoxy-2-pyridinyl)propan-2-ol is COc1ccc(CC(C)O)nc1.
What is the InChIKey of 1-(5-methoxy-2-pyridinyl)propan-2-ol?
The InChIKey is MIRCUILOTWXUMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c1-7(11)5-8-3-4-9(12-2)6-10-8/h3-4,6-7,11H,5H2,1-2H3.
What are the key properties of 1-(5-methoxy-2-pyridinyl)propan-2-ol?
1-(5-methoxy-2-pyridinyl)propan-2-ol has a molecular weight of 167.21 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methoxy-2-pyridinyl)propan-2-ol is sourced from PubChem (CID 83675700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).