ethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine

C7H14F3NO — CID 166529328

IUPACethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine
SMILESCC.FC(F)(F)CN1CCCO1
InChIInChI=1S/C5H8F3NO.C2H6/c6-5(7,8)4-9-2-1-3-10-9;1-2/h1-4H2;1-2H3
InChIKeyFSLVPRHLJCAFOV-UHFFFAOYSA-N
MW185.19 g/mol
LogP2.21
Rot. Bonds1

About ethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine

ethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine (PubChem CID 166529328) has the molecular formula C7H14F3NO and a molecular weight of 185.19 g/mol. Its IUPAC name is ethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine.

Molecular Properties

Compound Nameethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine
PubChem CID166529328
Molecular FormulaC7H14F3NO
Molecular Weight185.19 g/mol
Exact Mass185.10
IUPAC Nameethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine
SMILESCC.FC(F)(F)CN1CCCO1
InChIInChI=1S/C5H8F3NO.C2H6/c6-5(7,8)4-9-2-1-3-10-9;1-2/h1-4H2;1-2H3
InChIKeyFSLVPRHLJCAFOV-UHFFFAOYSA-N
XLogP2.21
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.19
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine?
The IUPAC name of ethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine (CID 166529328) is ethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine.
What is the SMILES notation for ethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine?
The canonical SMILES for ethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine is CC.FC(F)(F)CN1CCCO1.
What is the InChIKey of ethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine?
The InChIKey is FSLVPRHLJCAFOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8F3NO.C2H6/c6-5(7,8)4-9-2-1-3-10-9;1-2/h1-4H2;1-2H3.
What are the key properties of ethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine?
ethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine has a molecular weight of 185.19 g/mol, XLogP of 2.21, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine is sourced from PubChem (CID 166529328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).