methyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride

C8H11ClN2O3 — CID 71544878

IUPACmethyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride
SMILESCOC(=O)c1nc(OC)ccc1N.Cl
InChIInChI=1S/C8H10N2O3.ClH/c1-12-6-4-3-5(9)7(10-6)8(11)13-2;/h3-4H,9H2,1-2H3;1H
InChIKeyHYESTILLRRZUOI-UHFFFAOYSA-N
MW218.64 g/mol
LogP0.88
Rot. Bonds2

About methyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride

methyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride (PubChem CID 71544878) has the molecular formula C8H11ClN2O3 and a molecular weight of 218.64 g/mol. Its IUPAC name is methyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride.

Molecular Properties

Compound Namemethyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride
PubChem CID71544878
Molecular FormulaC8H11ClN2O3
Molecular Weight218.64 g/mol
Exact Mass218.05
IUPAC Namemethyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride
SMILESCOC(=O)c1nc(OC)ccc1N.Cl
InChIInChI=1S/C8H10N2O3.ClH/c1-12-6-4-3-5(9)7(10-6)8(11)13-2;/h3-4H,9H2,1-2H3;1H
InChIKeyHYESTILLRRZUOI-UHFFFAOYSA-N
XLogP0.88
TPSA74.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.64
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 3-amino-6-(trifluoromethyl)pyridine-2-carboxylate
CID 53417431
methyl 3-amino-6-(methoxymethyl)pyridine-2-carboxylate
CID 70098483
methyl 3-amino-6-(methylsulfamoyl)pyridine-2-carboxylate
CID 177315632
methyl 6-methoxy-3-pyridin-4-ylpyridine-2-carboxylate
CID 46317644
ethane;methyl 3-aminopyridine-2-carboxylate
CID 168887245
6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride
CID 22731600
dimethyl 3,6-diaminopyrazine-2,5-dicarboxylate
CID 15404197
methyl 6-methoxy-3-pyridin-3-ylpyridine-2-carboxylate
CID 46317643
methyl 3-amino-6-thiophen-2-ylpyridine-2-carboxylate
CID 167489425
methyl 4-aminopyridazine-3-carboxylate
CID 166610770
methyl 3-amino-5-bromo-6-methoxypyridine-2-carboxylate
CID 155682412
methyl 5-amino-2-methylpyrimidine-4-carboxylate
CID 84717183

Frequently Asked Questions

What is the IUPAC name of methyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride?
The IUPAC name of methyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride (CID 71544878) is methyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride.
What is the SMILES notation for methyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride?
The canonical SMILES for methyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride is COC(=O)c1nc(OC)ccc1N.Cl.
What is the InChIKey of methyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride?
The InChIKey is HYESTILLRRZUOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3.ClH/c1-12-6-4-3-5(9)7(10-6)8(11)13-2;/h3-4H,9H2,1-2H3;1H.
What are the key properties of methyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride?
methyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride has a molecular weight of 218.64 g/mol, XLogP of 0.88, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-amino-6-methoxypyridine-2-carboxylate;hydrochloride is sourced from PubChem (CID 71544878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).