5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine

C10H11F2NO — CID 161163437

IUPAC5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine
SMILESFc1cccc(F)c1CC1CNCO1
InChIInChI=1S/C10H11F2NO/c11-9-2-1-3-10(12)8(9)4-7-5-13-6-14-7/h1-3,7,13H,4-6H2
InChIKeyUQFJUJBONZBHEN-UHFFFAOYSA-N
MW199.20 g/mol
LogP1.45
Rot. Bonds2

About 5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine

5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine (PubChem CID 161163437) has the molecular formula C10H11F2NO and a molecular weight of 199.20 g/mol. Its IUPAC name is 5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine.

Molecular Properties

Compound Name5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine
PubChem CID161163437
Molecular FormulaC10H11F2NO
Molecular Weight199.20 g/mol
Exact Mass199.08
IUPAC Name5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine
SMILESFc1cccc(F)c1CC1CNCO1
InChIInChI=1S/C10H11F2NO/c11-9-2-1-3-10(12)8(9)4-7-5-13-6-14-7/h1-3,7,13H,4-6H2
InChIKeyUQFJUJBONZBHEN-UHFFFAOYSA-N
XLogP1.45
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.20
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-[(2,6-difluorophenyl)methyl]-1,3-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 5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine?
The IUPAC name of 5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine (CID 161163437) is 5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine.
What is the SMILES notation for 5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine?
The canonical SMILES for 5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine is Fc1cccc(F)c1CC1CNCO1.
What is the InChIKey of 5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine?
The InChIKey is UQFJUJBONZBHEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2NO/c11-9-2-1-3-10(12)8(9)4-7-5-13-6-14-7/h1-3,7,13H,4-6H2.
What are the key properties of 5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine?
5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine has a molecular weight of 199.20 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,6-difluorophenyl)methyl]-1,3-oxazolidine is sourced from PubChem (CID 161163437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).