5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine

C19H16FN3O2 — CID 134806405

IUPAC5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine
SMILESCc1cc2cc(-c3c(C)noc3C)nc(Nc3ccc(F)cc3)c2o1
InChIInChI=1S/C19H16FN3O2/c1-10-8-13-9-16(17-11(2)23-25-12(17)3)22-19(18(13)24-10)21-15-6-4-14(20)5-7-15/h4-9H,1-3H3,(H,21,22)
InChIKeyXDZRDSPQQDMORP-UHFFFAOYSA-N
MW337.35 g/mol
LogP5.29
Rot. Bonds3

About 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine

5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine (PubChem CID 134806405) has the molecular formula C19H16FN3O2 and a molecular weight of 337.35 g/mol. Its IUPAC name is 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine.

Molecular Properties

Compound Name5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine
PubChem CID134806405
Molecular FormulaC19H16FN3O2
Molecular Weight337.35 g/mol
Exact Mass337.12
IUPAC Name5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine
SMILESCc1cc2cc(-c3c(C)noc3C)nc(Nc3ccc(F)cc3)c2o1
InChIInChI=1S/C19H16FN3O2/c1-10-8-13-9-16(17-11(2)23-25-12(17)3)22-19(18(13)24-10)21-15-6-4-14(20)5-7-15/h4-9H,1-3H3,(H,21,22)
InChIKeyXDZRDSPQQDMORP-UHFFFAOYSA-N
XLogP5.29
TPSA64.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.35
LogP ≤ 55.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine?
The IUPAC name of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine (CID 134806405) is 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine.
What is the SMILES notation for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine?
The canonical SMILES for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine is Cc1cc2cc(-c3c(C)noc3C)nc(Nc3ccc(F)cc3)c2o1.
What is the InChIKey of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine?
The InChIKey is XDZRDSPQQDMORP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O2/c1-10-8-13-9-16(17-11(2)23-25-12(17)3)22-19(18(13)24-10)21-15-6-4-14(20)5-7-15/h4-9H,1-3H3,(H,21,22).
What are the key properties of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine?
5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine has a molecular weight of 337.35 g/mol, XLogP of 5.29, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluorophenyl)-2-methylfuro[2,3-c]pyridin-7-amine is sourced from PubChem (CID 134806405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).