4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride

C9H14ClNO2 — CID 52993164

IUPAC4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride
SMILESCOCc1c(C)cnc(C)c1O.Cl
InChIInChI=1S/C9H13NO2.ClH/c1-6-4-10-7(2)9(11)8(6)5-12-3;/h4,11H,5H2,1-3H3;1H
InChIKeyWNVAMMRKJVHTNC-UHFFFAOYSA-N
MW203.67 g/mol
LogP1.97
Rot. Bonds2

About 4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride

4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride (PubChem CID 52993164) has the molecular formula C9H14ClNO2 and a molecular weight of 203.67 g/mol. Its IUPAC name is 4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride.

Molecular Properties

Compound Name4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride
PubChem CID52993164
Molecular FormulaC9H14ClNO2
Molecular Weight203.67 g/mol
Exact Mass203.07
IUPAC Name4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride
SMILESCOCc1c(C)cnc(C)c1O.Cl
InChIInChI=1S/C9H13NO2.ClH/c1-6-4-10-7(2)9(11)8(6)5-12-3;/h4,11H,5H2,1-3H3;1H
InChIKeyWNVAMMRKJVHTNC-UHFFFAOYSA-N
XLogP1.97
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.67
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride?
The IUPAC name of 4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride (CID 52993164) is 4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride.
What is the SMILES notation for 4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride?
The canonical SMILES for 4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride is COCc1c(C)cnc(C)c1O.Cl.
What is the InChIKey of 4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride?
The InChIKey is WNVAMMRKJVHTNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2.ClH/c1-6-4-10-7(2)9(11)8(6)5-12-3;/h4,11H,5H2,1-3H3;1H.
What are the key properties of 4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride?
4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride has a molecular weight of 203.67 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-2,5-dimethylpyridin-3-ol;hydrochloride is sourced from PubChem (CID 52993164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).