2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid

C11H11N3O3 — CID 53222598

IUPAC2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid
SMILESCc1noc(C)c1-c1cnc(N)cc1C(=O)O
InChIInChI=1S/C11H11N3O3/c1-5-10(6(2)17-14-5)8-4-13-9(12)3-7(8)11(15)16/h3-4H,1-2H3,(H2,12,13)(H,15,16)
InChIKeyNZTALOLJPQQCOO-UHFFFAOYSA-N
MW233.23 g/mol
LogP1.63
Rot. Bonds2

About 2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid

2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid (PubChem CID 53222598) has the molecular formula C11H11N3O3 and a molecular weight of 233.23 g/mol. Its IUPAC name is 2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid
PubChem CID53222598
Molecular FormulaC11H11N3O3
Molecular Weight233.23 g/mol
Exact Mass233.08
IUPAC Name2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid
SMILESCc1noc(C)c1-c1cnc(N)cc1C(=O)O
InChIInChI=1S/C11H11N3O3/c1-5-10(6(2)17-14-5)8-4-13-9(12)3-7(8)11(15)16/h3-4H,1-2H3,(H2,12,13)(H,15,16)
InChIKeyNZTALOLJPQQCOO-UHFFFAOYSA-N
XLogP1.63
TPSA102.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3,5-dimethyl-1,2-oxazol-4-yl)benzoic acid
CID 15354514
3-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(methylamino)benzoic acid
CID 141423687
2-amino-5-(4-ethylthiophen-2-yl)pyridine-4-carboxylic acid
CID 53445519
2-amino-5-(3-fluoro-4-methylphenyl)pyridine-4-carboxylic acid
CID 53222855
2-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-3-carboxylic acid
CID 53222591
2-chloro-4-(3,5-dimethyl-1,2-oxazol-4-yl)benzoic acid
CID 53225038
6-(3,5-dimethyl-1,2-oxazol-4-yl)isoquinolin-3-amine
CID 118980517
7-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methoxy-4-[[(2R)-1-methoxypropan-2-yl]amino]quinoline-3-carboxylic acid
CID 90222565
3-(1-aminoethenyl)-7-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methoxyquinolin-4-amine
CID 89426764
2-amino-5-(4-cyanophenyl)pyridine-4-carboxylic acid
CID 53222623
4-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-pyrrole-2-carboxylic acid
CID 165455449
2-amino-5-[3-(methylcarbamoyl)phenyl]pyridine-4-carboxylic acid
CID 53223665

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid?
The IUPAC name of 2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid (CID 53222598) is 2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid.
What is the SMILES notation for 2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid?
The canonical SMILES for 2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid is Cc1noc(C)c1-c1cnc(N)cc1C(=O)O.
What is the InChIKey of 2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid?
The InChIKey is NZTALOLJPQQCOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O3/c1-5-10(6(2)17-14-5)8-4-13-9(12)3-7(8)11(15)16/h3-4H,1-2H3,(H2,12,13)(H,15,16).
What are the key properties of 2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid?
2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid has a molecular weight of 233.23 g/mol, XLogP of 1.63, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(3,5-dimethyl-1,2-oxazol-4-yl)pyridine-4-carboxylic acid is sourced from PubChem (CID 53222598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).