5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole

C7H8FNO — CID 166923913

IUPAC5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole
SMILESC=Cc1oc(C)nc1CF
InChIInChI=1S/C7H8FNO/c1-3-7-6(4-8)9-5(2)10-7/h3H,1,4H2,2H3
InChIKeyQYBLYQUDUQGQFA-UHFFFAOYSA-N
MW141.14 g/mol
LogP2.10
Rot. Bonds2

About 5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole

5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole (PubChem CID 166923913) has the molecular formula C7H8FNO and a molecular weight of 141.14 g/mol. Its IUPAC name is 5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole.

Molecular Properties

Compound Name5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole
PubChem CID166923913
Molecular FormulaC7H8FNO
Molecular Weight141.14 g/mol
Exact Mass141.06
IUPAC Name5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole
SMILESC=Cc1oc(C)nc1CF
InChIInChI=1S/C7H8FNO/c1-3-7-6(4-8)9-5(2)10-7/h3H,1,4H2,2H3
InChIKeyQYBLYQUDUQGQFA-UHFFFAOYSA-N
XLogP2.10
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.14
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-Ethenyl-2,5-dimethyl-1,3-oxazole
CID 15176132
5-[(Z)-3-fluoroprop-1-enyl]-2,4-dimethyl-1,3-oxazole
CID 141904051
5-ethenyl-2-propan-2-yl-4-[(1Z,3E)-5,5,5-trifluoropenta-1,3-dienyl]-1,3-oxazole
CID 167089457
4,5-dimethyl-2-[(E)-prop-1-enyl]-1,3-oxazole
CID 15176124
4,5-bis(ethenyl)-2-[(3Z,5Z)-3-fluorohepta-1,3,5-trien-4-yl]-1,3-oxazole
CID 142810880
4,5-dimethyl-2-[(2E,4E)-5-(trifluoromethyl)hepta-2,4,6-trien-2-yl]-1,3-oxazole
CID 149289412
2-Ethenyl-4,5-dimethyl-1,3-oxazole
CID 20200003
2-[(E)-hex-1-enyl]-4,5-dimethyl-1,3-oxazole
CID 57753804
4,5-dimethyl-2-[(E)-pent-1-enyl]-1,3-oxazole
CID 57753807
2,4-Dimethyl-5-prop-1-en-2-yl-1,3-oxazole
CID 70331634
2,4-dimethyl-5-[(1Z)-3-methylbuta-1,3-dienyl]-1,3-oxazole
CID 88901131
2-[(3Z)-hexa-1,3,5-trien-2-yl]-4,5-dimethyl-1,3-oxazole
CID 89003626

Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole?
The IUPAC name of 5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole (CID 166923913) is 5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole.
What is the SMILES notation for 5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole?
The canonical SMILES for 5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole is C=Cc1oc(C)nc1CF.
What is the InChIKey of 5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole?
The InChIKey is QYBLYQUDUQGQFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FNO/c1-3-7-6(4-8)9-5(2)10-7/h3H,1,4H2,2H3.
What are the key properties of 5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole?
5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole has a molecular weight of 141.14 g/mol, XLogP of 2.10, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-4-(fluoromethyl)-2-methyl-1,3-oxazole is sourced from PubChem (CID 166923913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).