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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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).