5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one

C5H7F2NO2 — CID 67519480

IUPAC5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one
SMILESO=C1NCC(CC(F)F)O1
InChIInChI=1S/C5H7F2NO2/c6-4(7)1-3-2-8-5(9)10-3/h3-4H,1-2H2,(H,8,9)
InChIKeyXBHAAYPMXNETIX-UHFFFAOYSA-N
MW151.11 g/mol
LogP0.75
Rot. Bonds2

About 5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one

5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one (PubChem CID 67519480) has the molecular formula C5H7F2NO2 and a molecular weight of 151.11 g/mol. Its IUPAC name is 5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one
PubChem CID67519480
Molecular FormulaC5H7F2NO2
Molecular Weight151.11 g/mol
Exact Mass151.04
IUPAC Name5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one
SMILESO=C1NCC(CC(F)F)O1
InChIInChI=1S/C5H7F2NO2/c6-4(7)1-3-2-8-5(9)10-3/h3-4H,1-2H2,(H,8,9)
InChIKeyXBHAAYPMXNETIX-UHFFFAOYSA-N
XLogP0.75
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.11
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-Methyl-2-oxazolidinone
CID 136837
4-(Trifluoromethyl)-1,3-oxazolidin-2-one
CID 21478216
5-Ethyloxazolidin-2-one
CID 13704589
(R)-5-methyloxazolidin-2-one
CID 21794662
5-(Difluoromethyl)-1,3-oxazolidin-2-one
CID 67519293
(4S)-4-(Difluoromethyl)-1,3-oxazolidin-2-one
CID 124173646
(5R)-5-ethyl-1,3-oxazolidin-2-one
CID 59967858
5-(Trifluoromethyl)oxazolidin-2-one
CID 13649648
5-(Fluoromethyl)-1,3-oxazolidin-2-one
CID 21919473
5-(2-Azido-1,1-difluoroethyl)-1,3-oxazolidin-2-one
CID 53709919
5-(1,1-Difluoro-2-propan-2-yloxyethyl)-1,3-oxazolidin-2-one
CID 53769863
5-(1,1-Difluoro-2-hydroxyethyl)-1,3-oxazolidin-2-one
CID 54224687

Frequently Asked Questions

What is the IUPAC name of 5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one?
The IUPAC name of 5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one (CID 67519480) is 5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one is O=C1NCC(CC(F)F)O1.
What is the InChIKey of 5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one?
The InChIKey is XBHAAYPMXNETIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7F2NO2/c6-4(7)1-3-2-8-5(9)10-3/h3-4H,1-2H2,(H,8,9).
What are the key properties of 5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one?
5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one has a molecular weight of 151.11 g/mol, XLogP of 0.75, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,2-difluoroethyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 67519480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).