4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one

C5H8FNO2 — CID 67255510

IUPAC4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one
SMILESCN1C(=O)OCC1CF
InChIInChI=1S/C5H8FNO2/c1-7-4(2-6)3-9-5(7)8/h4H,2-3H2,1H3
InChIKeyIEEAMRKUHHMECZ-UHFFFAOYSA-N
MW133.12 g/mol
LogP0.41
Rot. Bonds1

About 4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one

4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one (PubChem CID 67255510) has the molecular formula C5H8FNO2 and a molecular weight of 133.12 g/mol. Its IUPAC name is 4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one
PubChem CID67255510
Molecular FormulaC5H8FNO2
Molecular Weight133.12 g/mol
Exact Mass133.05
IUPAC Name4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one
SMILESCN1C(=O)OCC1CF
InChIInChI=1S/C5H8FNO2/c1-7-4(2-6)3-9-5(7)8/h4H,2-3H2,1H3
InChIKeyIEEAMRKUHHMECZ-UHFFFAOYSA-N
XLogP0.41
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.12
LogP ≤ 50.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Oxazolidinone, 3-methyl-
CID 29831
3-Ethyl-1,3-oxazolidin-2-one
CID 350825
3-Isopropyl-1,3-oxazolidin-2-one
CID 237194
3-tert-Butyl-1,3-oxazolidin-2-one
CID 581833
(5S)-5-fluoro-3-methyl-1,3-oxazolidin-2-one
CID 178338345
3-Propyl-1,3-oxazolidin-2-one
CID 12238104
3,4,4-Trimethyl-1,3-oxazolidin-2-one
CID 22949116
4,5-Difluoro-3-methyl-1,3-oxazolidin-2-one
CID 11535571
3-Tert-butyl-5-fluoro-1,3-oxazolidin-2-one
CID 59667884
3-Ethyl-4-(fluoromethyl)-1,3-oxazolidin-2-one
CID 67253762
3-Ethyl-4-(2-fluoroethyl)-1,3-oxazolidin-2-one
CID 67254228
4-(Difluoromethyl)-3-methyl-1,3-oxazolidin-2-one
CID 67254993

Frequently Asked Questions

What is the IUPAC name of 4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one?
The IUPAC name of 4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one (CID 67255510) is 4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one?
The canonical SMILES for 4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one is CN1C(=O)OCC1CF.
What is the InChIKey of 4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one?
The InChIKey is IEEAMRKUHHMECZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8FNO2/c1-7-4(2-6)3-9-5(7)8/h4H,2-3H2,1H3.
What are the key properties of 4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one?
4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one has a molecular weight of 133.12 g/mol, XLogP of 0.41, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(fluoromethyl)-3-methyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 67255510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).