(5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine

C12H15F2NO2 — CID 134567718

IUPAC(5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine
SMILESCOCCN1CC[C@@H](c2ccc(F)c(F)c2)O1
InChIInChI=1S/C12H15F2NO2/c1-16-7-6-15-5-4-12(17-15)9-2-3-10(13)11(14)8-9/h2-3,8,12H,4-7H2,1H3/t12-/m0/s1
InChIKeyMFJUAFXRAFFDRT-LBPRGKRZSA-N
MW243.25 g/mol
LogP2.29
Rot. Bonds4

About (5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine

(5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine (PubChem CID 134567718) has the molecular formula C12H15F2NO2 and a molecular weight of 243.25 g/mol. Its IUPAC name is (5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine.

Molecular Properties

Compound Name(5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine
PubChem CID134567718
Molecular FormulaC12H15F2NO2
Molecular Weight243.25 g/mol
Exact Mass243.11
IUPAC Name(5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine
SMILESCOCCN1CC[C@@H](c2ccc(F)c(F)c2)O1
InChIInChI=1S/C12H15F2NO2/c1-16-7-6-15-5-4-12(17-15)9-2-3-10(13)11(14)8-9/h2-3,8,12H,4-7H2,1H3/t12-/m0/s1
InChIKeyMFJUAFXRAFFDRT-LBPRGKRZSA-N
XLogP2.29
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.25
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine?
The IUPAC name of (5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine (CID 134567718) is (5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine.
What is the SMILES notation for (5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine?
The canonical SMILES for (5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine is COCCN1CC[C@@H](c2ccc(F)c(F)c2)O1.
What is the InChIKey of (5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine?
The InChIKey is MFJUAFXRAFFDRT-LBPRGKRZSA-N. The full InChI is InChI=1S/C12H15F2NO2/c1-16-7-6-15-5-4-12(17-15)9-2-3-10(13)11(14)8-9/h2-3,8,12H,4-7H2,1H3/t12-/m0/s1.
What are the key properties of (5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine?
(5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine has a molecular weight of 243.25 g/mol, XLogP of 2.29, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidine is sourced from PubChem (CID 134567718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).