5-(fluoromethyl)-1,3-oxazole

C4H4FNO — CID 173379071

IUPAC5-(fluoromethyl)-1,3-oxazole
SMILESFCc1cnco1
InChIInChI=1S/C4H4FNO/c5-1-4-2-6-3-7-4/h2-3H,1H2
InChIKeyBZKPTBJIUOFELR-UHFFFAOYSA-N
MW101.08 g/mol
LogP1.14
Rot. Bonds1

About 5-(fluoromethyl)-1,3-oxazole

5-(fluoromethyl)-1,3-oxazole (PubChem CID 173379071) has the molecular formula C4H4FNO and a molecular weight of 101.08 g/mol. Its IUPAC name is 5-(fluoromethyl)-1,3-oxazole.

Molecular Properties

Compound Name5-(fluoromethyl)-1,3-oxazole
PubChem CID173379071
Molecular FormulaC4H4FNO
Molecular Weight101.08 g/mol
Exact Mass101.03
IUPAC Name5-(fluoromethyl)-1,3-oxazole
SMILESFCc1cnco1
InChIInChI=1S/C4H4FNO/c5-1-4-2-6-3-7-4/h2-3H,1H2
InChIKeyBZKPTBJIUOFELR-UHFFFAOYSA-N
XLogP1.14
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.08
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-Dimethyloxazole
CID 89961
2-Ethyl-5-methyloxazole
CID 528403
5-(Bromomethyl)oxazole
CID 11665457
5-(1-Methylethyl)oxazole
CID 12214112
5-Ethyl-1,3-oxazole
CID 12214113
5-(Chloromethyl)-1,3-oxazole
CID 15290880
5-Ethynyloxazole
CID 17875436
5-(Trifluoromethyl)-1,3-oxazole
CID 54409704
Oxazol-5-ylmethanamine
CID 23404337
5-Methyloxazole
CID 528411
(1,3-Oxazol-5-yl)methanamine dihydrochloride
CID 71811106
5-Ethenyl-1,3-oxazole
CID 14362061

Frequently Asked Questions

What is the IUPAC name of 5-(fluoromethyl)-1,3-oxazole?
The IUPAC name of 5-(fluoromethyl)-1,3-oxazole (CID 173379071) is 5-(fluoromethyl)-1,3-oxazole.
What is the SMILES notation for 5-(fluoromethyl)-1,3-oxazole?
The canonical SMILES for 5-(fluoromethyl)-1,3-oxazole is FCc1cnco1.
What is the InChIKey of 5-(fluoromethyl)-1,3-oxazole?
The InChIKey is BZKPTBJIUOFELR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4FNO/c5-1-4-2-6-3-7-4/h2-3H,1H2.
What are the key properties of 5-(fluoromethyl)-1,3-oxazole?
5-(fluoromethyl)-1,3-oxazole has a molecular weight of 101.08 g/mol, XLogP of 1.14, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(fluoromethyl)-1,3-oxazole is sourced from PubChem (CID 173379071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).