3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride

C8H10ClNO3 — CID 138040147

IUPAC3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride
SMILESCOc1ccc(C)nc1C(=O)O.Cl
InChIInChI=1S/C8H9NO3.ClH/c1-5-3-4-6(12-2)7(9-5)8(10)11;/h3-4H,1-2H3,(H,10,11);1H
InChIKeyVYUMJRPLDDBCMV-UHFFFAOYSA-N
MW203.62 g/mol
LogP1.52
Rot. Bonds2

About 3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride

3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride (PubChem CID 138040147) has the molecular formula C8H10ClNO3 and a molecular weight of 203.62 g/mol. Its IUPAC name is 3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride.

Molecular Properties

Compound Name3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride
PubChem CID138040147
Molecular FormulaC8H10ClNO3
Molecular Weight203.62 g/mol
Exact Mass203.03
IUPAC Name3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride
SMILESCOc1ccc(C)nc1C(=O)O.Cl
InChIInChI=1S/C8H9NO3.ClH/c1-5-3-4-6(12-2)7(9-5)8(10)11;/h3-4H,1-2H3,(H,10,11);1H
InChIKeyVYUMJRPLDDBCMV-UHFFFAOYSA-N
XLogP1.52
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.62
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride?
The IUPAC name of 3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride (CID 138040147) is 3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride.
What is the SMILES notation for 3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride?
The canonical SMILES for 3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride is COc1ccc(C)nc1C(=O)O.Cl.
What is the InChIKey of 3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride?
The InChIKey is VYUMJRPLDDBCMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO3.ClH/c1-5-3-4-6(12-2)7(9-5)8(10)11;/h3-4H,1-2H3,(H,10,11);1H.
What are the key properties of 3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride?
3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride has a molecular weight of 203.62 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-6-methylpyridine-2-carboxylic acid;hydrochloride is sourced from PubChem (CID 138040147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).