5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione

C16H12FNO3 — CID 132574285

IUPAC5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione
SMILESO=C1OC(F)(Cc2ccccc2)C(=O)N1c1ccccc1
InChIInChI=1S/C16H12FNO3/c17-16(11-12-7-3-1-4-8-12)14(19)18(15(20)21-16)13-9-5-2-6-10-13/h1-10H,11H2
InChIKeySWXRLXMJODAJTA-UHFFFAOYSA-N
MW285.27 g/mol
LogP3.08
Rot. Bonds3

About 5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione

5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione (PubChem CID 132574285) has the molecular formula C16H12FNO3 and a molecular weight of 285.27 g/mol. Its IUPAC name is 5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione
PubChem CID132574285
Molecular FormulaC16H12FNO3
Molecular Weight285.27 g/mol
Exact Mass285.08
IUPAC Name5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione
SMILESO=C1OC(F)(Cc2ccccc2)C(=O)N1c1ccccc1
InChIInChI=1S/C16H12FNO3/c17-16(11-12-7-3-1-4-8-12)14(19)18(15(20)21-16)13-9-5-2-6-10-13/h1-10H,11H2
InChIKeySWXRLXMJODAJTA-UHFFFAOYSA-N
XLogP3.08
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.27
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5,5-dibenzyl-3-phenyl-2-sulfanylidene-1,3-oxazolidin-4-one
CID 134917365
5-benzyl-5-methyl-3-phenyl-2-sulfanylidene-1,3-oxazolidin-4-one
CID 13045960
(5R)-5-[(1S)-1-fluoroethyl]-5-methyl-3-phenyl-1,3-oxazolidine-2,4-dione
CID 139049260
(5-methyl-2,4-dioxo-3-phenyl-1,3-oxazolidin-5-yl)methyl acetate
CID 155926943
ethyl 5-methyl-2,4-dioxo-3-phenyl-1,3-oxazolidine-5-carboxylate
CID 20530498
4,4-dibenzyl-3,3-difluorooxetan-2-one
CID 10039731
3-phenyl-1-oxa-3-azaspiro[4.5]decane-2,4,8-trione
CID 15497951
5-benzyl-5-hydroxy-1-phenyl-1,3-diazinane-2,4,6-trione
CID 118199478
5-ethenyl-3,5-diphenyl-1,3-oxazolidine-2,4-dione
CID 168864617
3-amino-3-benzyl-1-phenylaziridin-2-one
CID 22094809
5-(3-oxobutyl)-3,5-diphenyl-1,3-oxazolidine-2,4-dione
CID 102476767
1-benzyl-4,7,8,11-tetraphenyl-4,8,11-triazatricyclo[5.2.2.02,6]undecane-3,5,9,10-tetrone
CID 2786314

Frequently Asked Questions

What is the IUPAC name of 5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione?
The IUPAC name of 5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione (CID 132574285) is 5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione is O=C1OC(F)(Cc2ccccc2)C(=O)N1c1ccccc1.
What is the InChIKey of 5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione?
The InChIKey is SWXRLXMJODAJTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FNO3/c17-16(11-12-7-3-1-4-8-12)14(19)18(15(20)21-16)13-9-5-2-6-10-13/h1-10H,11H2.
What are the key properties of 5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione?
5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione has a molecular weight of 285.27 g/mol, XLogP of 3.08, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-5-fluoro-3-phenyl-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 132574285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).