3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid

C11H11N3O4 — CID 155585490

IUPAC3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid
SMILESCOc1cc(Nc2ncc(C)o2)cnc1C(=O)O
InChIInChI=1S/C11H11N3O4/c1-6-4-13-11(18-6)14-7-3-8(17-2)9(10(15)16)12-5-7/h3-5H,1-2H3,(H,13,14)(H,15,16)
InChIKeyZXZPZVDINBKSAH-UHFFFAOYSA-N
MW249.23 g/mol
LogP1.83
Rot. Bonds4

About 3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid

3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid (PubChem CID 155585490) has the molecular formula C11H11N3O4 and a molecular weight of 249.23 g/mol. Its IUPAC name is 3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid
PubChem CID155585490
Molecular FormulaC11H11N3O4
Molecular Weight249.23 g/mol
Exact Mass249.07
IUPAC Name3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid
SMILESCOc1cc(Nc2ncc(C)o2)cnc1C(=O)O
InChIInChI=1S/C11H11N3O4/c1-6-4-13-11(18-6)14-7-3-8(17-2)9(10(15)16)12-5-7/h3-5H,1-2H3,(H,13,14)(H,15,16)
InChIKeyZXZPZVDINBKSAH-UHFFFAOYSA-N
XLogP1.83
TPSA97.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.23
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-methoxy-5-methoxycarbonylpyridine-2-carboxylic acid
CID 22923874
5-isocyano-3-methoxypyridine-2-carboxylic acid
CID 123528832
5-ethoxycarbonyl-3-methoxypyridine-2-carboxylic acid
CID 22923766
ethyl 2-methoxy-4-[(5-phenyl-1,3-oxazol-2-yl)amino]benzoate
CID 139225247
4-[2-(3-methoxyanilino)-1,3-oxazol-5-yl]benzoic acid
CID 166108179
3-methoxy-5-propoxycarbonylpyridine-2-carboxylic acid
CID 22923898
ethyl 2-(2-methoxyanilino)-1,3-oxazole-5-carboxylate
CID 139225277
N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine
CID 167549818
3-methoxy-5-pentan-3-yloxycarbonylpyridine-2-carboxylic acid
CID 67716166
2-methoxy-4-[(5-methylpyrimidin-2-yl)amino]benzoic acid
CID 107208994
1-(5-amino-3-methoxy-2-pyridinyl)ethanone
CID 130047706
3-hydroxypyridine-2-carboxylic acid;3-methoxypyridine-2-carboxylic acid;methyl 3-methoxypyridine-2-carboxylate
CID 162061282

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid?
The IUPAC name of 3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid (CID 155585490) is 3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid.
What is the SMILES notation for 3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid?
The canonical SMILES for 3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid is COc1cc(Nc2ncc(C)o2)cnc1C(=O)O.
What is the InChIKey of 3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid?
The InChIKey is ZXZPZVDINBKSAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O4/c1-6-4-13-11(18-6)14-7-3-8(17-2)9(10(15)16)12-5-7/h3-5H,1-2H3,(H,13,14)(H,15,16).
What are the key properties of 3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid?
3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid has a molecular weight of 249.23 g/mol, XLogP of 1.83, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid is sourced from PubChem (CID 155585490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).