2-(4-methoxy-3-pyridinyl)propan-2-ol

C9H13NO2 — CID 115009163

IUPAC2-(4-methoxy-3-pyridinyl)propan-2-ol
SMILESCOc1ccncc1C(C)(C)O
InChIInChI=1S/C9H13NO2/c1-9(2,11)7-6-10-5-4-8(7)12-3/h4-6,11H,1-3H3
InChIKeySREXKNLIUJFWJL-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.32
Rot. Bonds2

About 2-(4-methoxy-3-pyridinyl)propan-2-ol

2-(4-methoxy-3-pyridinyl)propan-2-ol (PubChem CID 115009163) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is 2-(4-methoxy-3-pyridinyl)propan-2-ol.

Molecular Properties

Compound Name2-(4-methoxy-3-pyridinyl)propan-2-ol
PubChem CID115009163
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name2-(4-methoxy-3-pyridinyl)propan-2-ol
SMILESCOc1ccncc1C(C)(C)O
InChIInChI=1S/C9H13NO2/c1-9(2,11)7-6-10-5-4-8(7)12-3/h4-6,11H,1-3H3
InChIKeySREXKNLIUJFWJL-UHFFFAOYSA-N
XLogP1.32
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-propan-2-yloxy-3-pyridinyl)propan-2-ol
CID 84666329
2-(4-methoxy-3-pyridinyl)-2-methylpropanoic acid
CID 115009175
1-(1,3-benzothiazol-2-yl)-1-(4-methoxy-3-pyridinyl)-2,2-dimethylpropan-1-ol
CID 121457838
ethane;2-(3-methyl-4-pyridinyl)propan-2-ol
CID 145265708
3-(2-hydroxypropan-2-yl)pyridine-4-carboxylic acid
CID 175712799
4-methoxypyridine-3-thiolate
CID 156636966
1-(4-methoxy-3-pyridinyl)propane-1,2-diol
CID 130565658
2-(3-propan-2-yl-4-pyridinyl)propan-2-ol
CID 115008742
3-(iodomethyl)-4-methoxypyridine
CID 130559780
4-[amino-(4-methoxy-3-pyridinyl)methyl]-3,5-ditert-butylphenol
CID 70157537
3-(4-tert-butyl-2,5-dimethoxyphenyl)-4-methoxypyridine
CID 54187127
4-methoxypyridin-3-amine;dihydrochloride
CID 163333119

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxy-3-pyridinyl)propan-2-ol?
The IUPAC name of 2-(4-methoxy-3-pyridinyl)propan-2-ol (CID 115009163) is 2-(4-methoxy-3-pyridinyl)propan-2-ol.
What is the SMILES notation for 2-(4-methoxy-3-pyridinyl)propan-2-ol?
The canonical SMILES for 2-(4-methoxy-3-pyridinyl)propan-2-ol is COc1ccncc1C(C)(C)O.
What is the InChIKey of 2-(4-methoxy-3-pyridinyl)propan-2-ol?
The InChIKey is SREXKNLIUJFWJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c1-9(2,11)7-6-10-5-4-8(7)12-3/h4-6,11H,1-3H3.
What are the key properties of 2-(4-methoxy-3-pyridinyl)propan-2-ol?
2-(4-methoxy-3-pyridinyl)propan-2-ol has a molecular weight of 167.21 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxy-3-pyridinyl)propan-2-ol is sourced from PubChem (CID 115009163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).