2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole

C10H7FN2O — CID 175956001

IUPAC2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole
SMILESFc1cccnc1C=Cc1ncco1
InChIInChI=1S/C10H7FN2O/c11-8-2-1-5-12-9(8)3-4-10-13-6-7-14-10/h1-7H
InChIKeyOODMQMXMBGXROY-UHFFFAOYSA-N
MW190.18 g/mol
LogP2.38
Rot. Bonds2

About 2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole

2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole (PubChem CID 175956001) has the molecular formula C10H7FN2O and a molecular weight of 190.18 g/mol. Its IUPAC name is 2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole.

Molecular Properties

Compound Name2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole
PubChem CID175956001
Molecular FormulaC10H7FN2O
Molecular Weight190.18 g/mol
Exact Mass190.05
IUPAC Name2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole
SMILESFc1cccnc1C=Cc1ncco1
InChIInChI=1S/C10H7FN2O/c11-8-2-1-5-12-9(8)3-4-10-13-6-7-14-10/h1-7H
InChIKeyOODMQMXMBGXROY-UHFFFAOYSA-N
XLogP2.38
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.18
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole?
The IUPAC name of 2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole (CID 175956001) is 2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole.
What is the SMILES notation for 2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole?
The canonical SMILES for 2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole is Fc1cccnc1C=Cc1ncco1.
What is the InChIKey of 2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole?
The InChIKey is OODMQMXMBGXROY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FN2O/c11-8-2-1-5-12-9(8)3-4-10-13-6-7-14-10/h1-7H.
What are the key properties of 2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole?
2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole has a molecular weight of 190.18 g/mol, XLogP of 2.38, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-fluoro-2-pyridinyl)ethenyl]-1,3-oxazole is sourced from PubChem (CID 175956001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).