(4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine

C6H11F2NO — CID 145228806

IUPAC(4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine
SMILESC[C@H]1CON(CC(F)F)C1
InChIInChI=1S/C6H11F2NO/c1-5-2-9(10-4-5)3-6(7)8/h5-6H,2-4H2,1H3/t5-/m1/s1
InChIKeyNVDLIZHXCVWKBQ-RXMQYKEDSA-N
MW151.16 g/mol
LogP1.13
Rot. Bonds2

About (4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine

(4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine (PubChem CID 145228806) has the molecular formula C6H11F2NO and a molecular weight of 151.16 g/mol. Its IUPAC name is (4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine.

Molecular Properties

Compound Name(4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine
PubChem CID145228806
Molecular FormulaC6H11F2NO
Molecular Weight151.16 g/mol
Exact Mass151.08
IUPAC Name(4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine
SMILESC[C@H]1CON(CC(F)F)C1
InChIInChI=1S/C6H11F2NO/c1-5-2-9(10-4-5)3-6(7)8/h5-6H,2-4H2,1H3/t5-/m1/s1
InChIKeyNVDLIZHXCVWKBQ-RXMQYKEDSA-N
XLogP1.13
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Trifluoromethylisoxazolidine
CID 89717889
1-(2,2,2-Trifluoroethoxy)pyrrolidine
CID 21619256
4-Methyl-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-3-ol
CID 123785987
2-(2,2,2-Trifluoroethyl)-1,2-oxazolidine
CID 151344715
Ethane;2-(2,2,2-trifluoroethyl)-1,2-oxazolidine
CID 166529328
2-(3-Fluoropropyl)-4-methyl-1,2-oxazolidine
CID 170951148
(5R)-2-tert-butyl-5-fluoro-1,2-oxazolidine
CID 172097543
(4S,5R)-2-tert-butyl-4,5-difluoro-1,2-oxazolidine
CID 172097611
2-Tert-butyl-5-fluoro-1,2-oxazolidine
CID 172097637
(4R,5R)-2-tert-butyl-4,5-difluoro-1,2-oxazolidine
CID 172097663
2-Tert-butyl-4,5-difluoro-1,2-oxazolidine
CID 172097732
(5S)-2-tert-butyl-5-fluoro-1,2-oxazolidine
CID 172097738

Frequently Asked Questions

What is the IUPAC name of (4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine?
The IUPAC name of (4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine (CID 145228806) is (4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine.
What is the SMILES notation for (4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine?
The canonical SMILES for (4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine is C[C@H]1CON(CC(F)F)C1.
What is the InChIKey of (4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine?
The InChIKey is NVDLIZHXCVWKBQ-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H11F2NO/c1-5-2-9(10-4-5)3-6(7)8/h5-6H,2-4H2,1H3/t5-/m1/s1.
What are the key properties of (4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine?
(4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine has a molecular weight of 151.16 g/mol, XLogP of 1.13, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-(2,2-difluoroethyl)-4-methyl-1,2-oxazolidine is sourced from PubChem (CID 145228806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).