3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one

C6H10FNO2 — CID 67255683

IUPAC3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one
SMILESCCN1CC(CF)OC1=O
InChIInChI=1S/C6H10FNO2/c1-2-8-4-5(3-7)10-6(8)9/h5H,2-4H2,1H3
InChIKeyHKPNJQPSZOPHRT-UHFFFAOYSA-N
MW147.15 g/mol
LogP0.80
Rot. Bonds2

About 3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one

3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one (PubChem CID 67255683) has the molecular formula C6H10FNO2 and a molecular weight of 147.15 g/mol. Its IUPAC name is 3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one
PubChem CID67255683
Molecular FormulaC6H10FNO2
Molecular Weight147.15 g/mol
Exact Mass147.07
IUPAC Name3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one
SMILESCCN1CC(CF)OC1=O
InChIInChI=1S/C6H10FNO2/c1-2-8-4-5(3-7)10-6(8)9/h5H,2-4H2,1H3
InChIKeyHKPNJQPSZOPHRT-UHFFFAOYSA-N
XLogP0.80
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.15
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-Hydroxypropyl)-5-methyl-2-oxazolidinone
CID 18802
3-Ethyl-1,3-oxazolidin-2-one
CID 350825
(5S)-5-[(dimethylamino)methyl]-3-methyl-1,3-oxazolidin-2-one
CID 58653718
3-Butyl-1,3-oxazolidin-2-one
CID 567723
(5R)-5-[(dimethylamino)methyl]-3-methyl-1,3-oxazolidin-2-one
CID 72545094
trimethyl-[[(5R)-3-methyl-2-oxo-1,3-oxazolidin-5-yl]methyl]azanium
CID 72545096
trimethyl-[[(5S)-3-methyl-2-oxo-1,3-oxazolidin-5-yl]methyl]azanium
CID 72545329
2-Oxazolidinone, 3-(1-ethoxyethyl)-5-methyl-
CID 14474965
5-(Bromomethyl)-3-ethyl-1,3-oxazolidin-2-one
CID 82395502
3,5-Dimethyl-1,3-oxazolidin-2-one
CID 13432443
(5S)-5-fluoro-3-methyl-1,3-oxazolidin-2-one
CID 178338345
3-Propyl-1,3-oxazolidin-2-one
CID 12238104

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one?
The IUPAC name of 3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one (CID 67255683) is 3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one is CCN1CC(CF)OC1=O.
What is the InChIKey of 3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one?
The InChIKey is HKPNJQPSZOPHRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10FNO2/c1-2-8-4-5(3-7)10-6(8)9/h5H,2-4H2,1H3.
What are the key properties of 3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one?
3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one has a molecular weight of 147.15 g/mol, XLogP of 0.80, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-(fluoromethyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 67255683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).