2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole

C17H11FN2O — CID 45276466

IUPAC2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole
SMILESFc1ccc(-c2nc(-c3c[nH]c4ccccc34)co2)cc1
InChIInChI=1S/C17H11FN2O/c18-12-7-5-11(6-8-12)17-20-16(10-21-17)14-9-19-15-4-2-1-3-13(14)15/h1-10,19H
InChIKeyGESXHQAEKWYPCW-UHFFFAOYSA-N
MW278.29 g/mol
LogP4.63
Rot. Bonds2

About 2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole

2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole (PubChem CID 45276466) has the molecular formula C17H11FN2O and a molecular weight of 278.29 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole.

Molecular Properties

Compound Name2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole
PubChem CID45276466
Molecular FormulaC17H11FN2O
Molecular Weight278.29 g/mol
Exact Mass278.09
IUPAC Name2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole
SMILESFc1ccc(-c2nc(-c3c[nH]c4ccccc34)co2)cc1
InChIInChI=1S/C17H11FN2O/c18-12-7-5-11(6-8-12)17-20-16(10-21-17)14-9-19-15-4-2-1-3-13(14)15/h1-10,19H
InChIKeyGESXHQAEKWYPCW-UHFFFAOYSA-N
XLogP4.63
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.29
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole?
The IUPAC name of 2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole (CID 45276466) is 2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole.
What is the SMILES notation for 2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole?
The canonical SMILES for 2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole is Fc1ccc(-c2nc(-c3c[nH]c4ccccc34)co2)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole?
The InChIKey is GESXHQAEKWYPCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11FN2O/c18-12-7-5-11(6-8-12)17-20-16(10-21-17)14-9-19-15-4-2-1-3-13(14)15/h1-10,19H.
What are the key properties of 2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole?
2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole has a molecular weight of 278.29 g/mol, XLogP of 4.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-4-(1H-indol-3-yl)-1,3-oxazole is sourced from PubChem (CID 45276466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).