5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide

C21H18FN3O4 — CID 134811199

IUPAC5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide
SMILESCNC(=O)c1cc2cc(-c3c(C)noc3C)nc(-c3ccc(F)cc3OC)c2o1
InChIInChI=1S/C21H18FN3O4/c1-10-18(11(2)29-25-10)15-7-12-8-17(21(26)23-3)28-20(12)19(24-15)14-6-5-13(22)9-16(14)27-4/h5-9H,1-4H3,(H,23,26)
InChIKeyRJVBVBRZWQWBBK-UHFFFAOYSA-N
MW395.39 g/mol
LogP4.27
Rot. Bonds4

About 5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide

5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide (PubChem CID 134811199) has the molecular formula C21H18FN3O4 and a molecular weight of 395.39 g/mol. Its IUPAC name is 5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide
PubChem CID134811199
Molecular FormulaC21H18FN3O4
Molecular Weight395.39 g/mol
Exact Mass395.13
IUPAC Name5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide
SMILESCNC(=O)c1cc2cc(-c3c(C)noc3C)nc(-c3ccc(F)cc3OC)c2o1
InChIInChI=1S/C21H18FN3O4/c1-10-18(11(2)29-25-10)15-7-12-8-17(21(26)23-3)28-20(12)19(24-15)14-6-5-13(22)9-16(14)27-4/h5-9H,1-4H3,(H,23,26)
InChIKeyRJVBVBRZWQWBBK-UHFFFAOYSA-N
XLogP4.27
TPSA90.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.39
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide?
The IUPAC name of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide (CID 134811199) is 5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide is CNC(=O)c1cc2cc(-c3c(C)noc3C)nc(-c3ccc(F)cc3OC)c2o1.
What is the InChIKey of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide?
The InChIKey is RJVBVBRZWQWBBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18FN3O4/c1-10-18(11(2)29-25-10)15-7-12-8-17(21(26)23-3)28-20(12)19(24-15)14-6-5-13(22)9-16(14)27-4/h5-9H,1-4H3,(H,23,26).
What are the key properties of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide?
5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide has a molecular weight of 395.39 g/mol, XLogP of 4.27, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoro-2-methoxyphenyl)-N-methylfuro[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 134811199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).