methyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate

C9H12N2O4 — CID 114408695

IUPACmethyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate
SMILESCOC(=O)c1ccc(N)c(OCCO)n1
InChIInChI=1S/C9H12N2O4/c1-14-9(13)7-3-2-6(10)8(11-7)15-5-4-12/h2-3,12H,4-5,10H2,1H3
InChIKeyQKHDVADMBYFUTH-UHFFFAOYSA-N
MW212.20 g/mol
LogP-0.18
Rot. Bonds4

About methyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate

methyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate (PubChem CID 114408695) has the molecular formula C9H12N2O4 and a molecular weight of 212.20 g/mol. Its IUPAC name is methyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate.

Molecular Properties

Compound Namemethyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate
PubChem CID114408695
Molecular FormulaC9H12N2O4
Molecular Weight212.20 g/mol
Exact Mass212.08
IUPAC Namemethyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate
SMILESCOC(=O)c1ccc(N)c(OCCO)n1
InChIInChI=1S/C9H12N2O4/c1-14-9(13)7-3-2-6(10)8(11-7)15-5-4-12/h2-3,12H,4-5,10H2,1H3
InChIKeyQKHDVADMBYFUTH-UHFFFAOYSA-N
XLogP-0.18
TPSA94.67 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.20
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 5-amino-6-[3-(dimethylamino)propoxy]pyridine-2-carboxylate
CID 114408846
methyl 5-amino-6-(3-phenylpropoxy)pyridine-2-carboxylate
CID 114408903
methyl 5-amino-6-[2-[cyclopropyl(methyl)amino]ethoxy]pyridine-2-carboxylate
CID 102740382
methyl 5-amino-6-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propoxy]pyridine-2-carboxylate
CID 135136562
methyl 6-(2-hydroxyethoxy)-5-nitropyridine-2-carboxylate
CID 114403191
methyl 5-amino-6-[(4-bromophenyl)methoxy]pyridine-2-carboxylate
CID 114409174
5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide
CID 114408602
2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol
CID 81133074
methyl 5-amino-6-(4-methylpentan-2-yloxy)pyridine-2-carboxylate
CID 114408539
methyl 5-amino-6-[(3-bromophenyl)methoxy]pyridine-2-carboxylate
CID 114409176
5-amino-6-butoxypyridine-2-carboxylic acid
CID 114408773
methyl 5-amino-6-(4-bromophenoxy)pyridine-2-carboxylate
CID 114408445

Frequently Asked Questions

What is the IUPAC name of methyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate?
The IUPAC name of methyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate (CID 114408695) is methyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate.
What is the SMILES notation for methyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate?
The canonical SMILES for methyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate is COC(=O)c1ccc(N)c(OCCO)n1.
What is the InChIKey of methyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate?
The InChIKey is QKHDVADMBYFUTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O4/c1-14-9(13)7-3-2-6(10)8(11-7)15-5-4-12/h2-3,12H,4-5,10H2,1H3.
What are the key properties of methyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate?
methyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate has a molecular weight of 212.20 g/mol, XLogP of -0.18, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-amino-6-(2-hydroxyethoxy)pyridine-2-carboxylate is sourced from PubChem (CID 114408695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).