5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine

C10H11ClFNO — CID 82471413

IUPAC5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine
SMILESCC1NCC(c2cc(Cl)ccc2F)O1
InChIInChI=1S/C10H11ClFNO/c1-6-13-5-10(14-6)8-4-7(11)2-3-9(8)12/h2-4,6,10,13H,5H2,1H3
InChIKeyCRPGEMULZXWKDS-UHFFFAOYSA-N
MW215.66 g/mol
LogP2.49
Rot. Bonds1

About 5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine

5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine (PubChem CID 82471413) has the molecular formula C10H11ClFNO and a molecular weight of 215.66 g/mol. Its IUPAC name is 5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine.

Molecular Properties

Compound Name5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine
PubChem CID82471413
Molecular FormulaC10H11ClFNO
Molecular Weight215.66 g/mol
Exact Mass215.05
IUPAC Name5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine
SMILESCC1NCC(c2cc(Cl)ccc2F)O1
InChIInChI=1S/C10H11ClFNO/c1-6-13-5-10(14-6)8-4-7(11)2-3-9(8)12/h2-4,6,10,13H,5H2,1H3
InChIKeyCRPGEMULZXWKDS-UHFFFAOYSA-N
XLogP2.49
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.66
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine?
The IUPAC name of 5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine (CID 82471413) is 5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine.
What is the SMILES notation for 5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine?
The canonical SMILES for 5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine is CC1NCC(c2cc(Cl)ccc2F)O1.
What is the InChIKey of 5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine?
The InChIKey is CRPGEMULZXWKDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClFNO/c1-6-13-5-10(14-6)8-4-7(11)2-3-9(8)12/h2-4,6,10,13H,5H2,1H3.
What are the key properties of 5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine?
5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine has a molecular weight of 215.66 g/mol, XLogP of 2.49, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-chloro-2-fluorophenyl)-2-methyl-1,3-oxazolidine is sourced from PubChem (CID 82471413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).