5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid

C14H15N3O3 — CID 114408858

IUPAC5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid
SMILESCN(C)c1cccc(Oc2nc(C(=O)O)ccc2N)c1
InChIInChI=1S/C14H15N3O3/c1-17(2)9-4-3-5-10(8-9)20-13-11(15)6-7-12(16-13)14(18)19/h3-8H,15H2,1-2H3,(H,18,19)
InChIKeyQOUITEDMYXFONK-UHFFFAOYSA-N
MW273.29 g/mol
LogP2.22
Rot. Bonds4

About 5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid

5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid (PubChem CID 114408858) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid
PubChem CID114408858
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid
SMILESCN(C)c1cccc(Oc2nc(C(=O)O)ccc2N)c1
InChIInChI=1S/C14H15N3O3/c1-17(2)9-4-3-5-10(8-9)20-13-11(15)6-7-12(16-13)14(18)19/h3-8H,15H2,1-2H3,(H,18,19)
InChIKeyQOUITEDMYXFONK-UHFFFAOYSA-N
XLogP2.22
TPSA88.68 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-6-(3-ethoxyphenoxy)pyridine-2-carboxylic acid
CID 114408919
5-amino-6-[3-(dimethylamino)phenoxy]pyridine-3-carboxylic acid
CID 81439249
6-[3-(dimethylamino)phenoxy]-5-methylpyridine-3-carboxylic acid
CID 80632781
5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid
CID 114409020
5-amino-6-quinolin-8-yloxypyridine-2-carboxylic acid
CID 114408715
6-(2-acetamidophenoxy)-5-aminopyridine-2-carboxylic acid
CID 114408530
5-amino-6-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxylic acid
CID 107709763
5-amino-6-[2-(trifluoromethyl)phenoxy]pyridine-2-carboxylic acid
CID 114408349
5-amino-6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxylic acid
CID 114408647
2-[3-(dimethylamino)phenoxy]-4-methylaniline
CID 26189579
5-amino-6-[3-(dimethylamino)phenoxy]pyridine-3-carbonitrile
CID 103469680
[3-(dimethylamino)phenyl] carbamate
CID 23622089

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid?
The IUPAC name of 5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid (CID 114408858) is 5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid.
What is the SMILES notation for 5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid?
The canonical SMILES for 5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid is CN(C)c1cccc(Oc2nc(C(=O)O)ccc2N)c1.
What is the InChIKey of 5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid?
The InChIKey is QOUITEDMYXFONK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-17(2)9-4-3-5-10(8-9)20-13-11(15)6-7-12(16-13)14(18)19/h3-8H,15H2,1-2H3,(H,18,19).
What are the key properties of 5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid?
5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid has a molecular weight of 273.29 g/mol, XLogP of 2.22, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid is sourced from PubChem (CID 114408858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).