[2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone

C19H11FN2O2 — CID 15077536

IUPAC[2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone
SMILESO=C(c1ccccc1)c1ccc2oc(-c3ccccc3F)nc2n1
InChIInChI=1S/C19H11FN2O2/c20-14-9-5-4-8-13(14)19-22-18-16(24-19)11-10-15(21-18)17(23)12-6-2-1-3-7-12/h1-11H
InChIKeyQTVYDTAFEZWNII-UHFFFAOYSA-N
MW318.31 g/mol
LogP4.26
Rot. Bonds3

About [2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone

[2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone (PubChem CID 15077536) has the molecular formula C19H11FN2O2 and a molecular weight of 318.31 g/mol. Its IUPAC name is [2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone.

Molecular Properties

Compound Name[2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone
PubChem CID15077536
Molecular FormulaC19H11FN2O2
Molecular Weight318.31 g/mol
Exact Mass318.08
IUPAC Name[2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone
SMILESO=C(c1ccccc1)c1ccc2oc(-c3ccccc3F)nc2n1
InChIInChI=1S/C19H11FN2O2/c20-14-9-5-4-8-13(14)19-22-18-16(24-19)11-10-15(21-18)17(23)12-6-2-1-3-7-12/h1-11H
InChIKeyQTVYDTAFEZWNII-UHFFFAOYSA-N
XLogP4.26
TPSA55.99 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.31
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone?
The IUPAC name of [2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone (CID 15077536) is [2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone.
What is the SMILES notation for [2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone?
The canonical SMILES for [2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone is O=C(c1ccccc1)c1ccc2oc(-c3ccccc3F)nc2n1.
What is the InChIKey of [2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone?
The InChIKey is QTVYDTAFEZWNII-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11FN2O2/c20-14-9-5-4-8-13(14)19-22-18-16(24-19)11-10-15(21-18)17(23)12-6-2-1-3-7-12/h1-11H.
What are the key properties of [2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone?
[2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone has a molecular weight of 318.31 g/mol, XLogP of 4.26, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-fluorophenyl)-[1,3]oxazolo[4,5-b]pyridin-5-yl]-phenylmethanone is sourced from PubChem (CID 15077536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).