6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid

C18H11FN2O5 — CID 9464094

IUPAC6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid
SMILESCOc1ccc(-c2cc(C(=O)O)c3c(-c4ccco4)noc3n2)c(F)c1
InChIInChI=1S/C18H11FN2O5/c1-24-9-4-5-10(12(19)7-9)13-8-11(18(22)23)15-16(14-3-2-6-25-14)21-26-17(15)20-13/h2-8H,1H3,(H,22,23)
InChIKeyAMHYFNDRUJYVKN-UHFFFAOYSA-N
MW354.29 g/mol
LogP4.00
Rot. Bonds4

About 6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid

6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid (PubChem CID 9464094) has the molecular formula C18H11FN2O5 and a molecular weight of 354.29 g/mol. Its IUPAC name is 6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid
PubChem CID9464094
Molecular FormulaC18H11FN2O5
Molecular Weight354.29 g/mol
Exact Mass354.07
IUPAC Name6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid
SMILESCOc1ccc(-c2cc(C(=O)O)c3c(-c4ccco4)noc3n2)c(F)c1
InChIInChI=1S/C18H11FN2O5/c1-24-9-4-5-10(12(19)7-9)13-8-11(18(22)23)15-16(14-3-2-6-25-14)21-26-17(15)20-13/h2-8H,1H3,(H,22,23)
InChIKeyAMHYFNDRUJYVKN-UHFFFAOYSA-N
XLogP4.00
TPSA98.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.29
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid with MolForge

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Related Compounds

6-(2-fluorophenyl)-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid
CID 29091420
methyl 2-[[6-(furan-2-yl)-3-(4-methylphenyl)-[1,2]oxazolo[5,4-b]pyridine-4-carbonyl]amino]acetate
CID 44824411
3-(furan-2-yl)-6-pyridin-3-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylate
CID 9464173
5-[4-(2-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methylphenyl)benzoic acid
CID 89470565
6-(furan-2-yl)-N-[2-(4-methoxyphenoxy)ethyl]-N,3-dimethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 31336264
3-(2-fluoro-4-methoxyphenyl)-2-methylbenzoic acid
CID 53226480
phenyl 6-(2-fluorophenyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylate
CID 24603258
6-(furan-2-yl)-N-(furan-2-ylmethyl)-3-(4-methylphenyl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 171315319
furan-2-yl-[4-[6-(furan-2-yl)-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carbonyl]piperazin-1-yl]methanone
CID 19615775
6-(furan-2-yl)-2-[(4-methoxyphenyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid
CID 118424984
[6-cyclopropyl-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridin-4-yl]-pyrrolidin-1-ylmethanone
CID 51081112
6-(furan-2-yl)-N-[(1R)-1-(3-methoxyphenyl)ethyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 51854607

Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid?
The IUPAC name of 6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid (CID 9464094) is 6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid.
What is the SMILES notation for 6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid?
The canonical SMILES for 6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid is COc1ccc(-c2cc(C(=O)O)c3c(-c4ccco4)noc3n2)c(F)c1.
What is the InChIKey of 6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid?
The InChIKey is AMHYFNDRUJYVKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11FN2O5/c1-24-9-4-5-10(12(19)7-9)13-8-11(18(22)23)15-16(14-3-2-6-25-14)21-26-17(15)20-13/h2-8H,1H3,(H,22,23).
What are the key properties of 6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid?
6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid has a molecular weight of 354.29 g/mol, XLogP of 4.00, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoro-4-methoxyphenyl)-3-(furan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid is sourced from PubChem (CID 9464094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).