5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid

C14H14N2O5 — CID 107744136

IUPAC5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid
SMILESCOc1cc(CO)ccc1Oc1nc(C(=O)O)ccc1N
InChIInChI=1S/C14H14N2O5/c1-20-12-6-8(7-17)2-5-11(12)21-13-9(15)3-4-10(16-13)14(18)19/h2-6,17H,7,15H2,1H3,(H,18,19)
InChIKeyGORIHLATYAWAIJ-UHFFFAOYSA-N
MW290.28 g/mol
LogP1.66
Rot. Bonds5

About 5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid

5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid (PubChem CID 107744136) has the molecular formula C14H14N2O5 and a molecular weight of 290.28 g/mol. Its IUPAC name is 5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid
PubChem CID107744136
Molecular FormulaC14H14N2O5
Molecular Weight290.28 g/mol
Exact Mass290.09
IUPAC Name5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid
SMILESCOc1cc(CO)ccc1Oc1nc(C(=O)O)ccc1N
InChIInChI=1S/C14H14N2O5/c1-20-12-6-8(7-17)2-5-11(12)21-13-9(15)3-4-10(16-13)14(18)19/h2-6,17H,7,15H2,1H3,(H,18,19)
InChIKeyGORIHLATYAWAIJ-UHFFFAOYSA-N
XLogP1.66
TPSA114.90 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.28
LogP ≤ 51.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-[4-(hydroxymethyl)-2-methoxyphenoxy]pyrimidine-4-carboxylic acid
CID 107744872
3-amino-2-[4-(hydroxymethyl)-2-methoxyphenoxy]benzoic acid
CID 107744126
3-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridazine-4-carboxylic acid
CID 107744881
5-amino-6-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxylic acid
CID 107709763
2-(4-ethyl-2-methoxyphenoxy)-6-methylpyridin-3-amine
CID 107663831
2-[4-(hydroxymethyl)-2-methoxyphenoxy]-6-methylpyridine-4-carboxamide
CID 107743933
[4-(2-amino-4-methoxyphenoxy)-3-methoxyphenyl]methanol
CID 107742492
[4-(2-amino-4-chlorophenoxy)-3-methoxyphenyl]methanol
CID 107742518
5-amino-6-(2-bromo-4-methoxyphenoxy)pyridine-2-carboxamide
CID 114409213
[4-(6-amino-5-ethylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol
CID 107745155
2-[4-(hydroxymethyl)-2-methoxyphenoxy]benzamide
CID 107743803
[4-[3-(aminomethyl)pyrazin-2-yl]oxy-3-methoxyphenyl]methanol
CID 107742464

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid?
The IUPAC name of 5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid (CID 107744136) is 5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid.
What is the SMILES notation for 5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid?
The canonical SMILES for 5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid is COc1cc(CO)ccc1Oc1nc(C(=O)O)ccc1N.
What is the InChIKey of 5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid?
The InChIKey is GORIHLATYAWAIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O5/c1-20-12-6-8(7-17)2-5-11(12)21-13-9(15)3-4-10(16-13)14(18)19/h2-6,17H,7,15H2,1H3,(H,18,19).
What are the key properties of 5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid?
5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid has a molecular weight of 290.28 g/mol, XLogP of 1.66, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-2-carboxylic acid is sourced from PubChem (CID 107744136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).