5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one

C10H10FNO2 — CID 3046891

IUPAC5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one
SMILESO=C1NCC(Cc2ccc(F)cc2)O1
InChIInChI=1S/C10H10FNO2/c11-8-3-1-7(2-4-8)5-9-6-12-10(13)14-9/h1-4,9H,5-6H2,(H,12,13)
InChIKeyYJQGCMLOVNBRLI-UHFFFAOYSA-N
MW195.19 g/mol
LogP1.48
Rot. Bonds2

About 5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one

5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one (PubChem CID 3046891) has the molecular formula C10H10FNO2 and a molecular weight of 195.19 g/mol. Its IUPAC name is 5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one
PubChem CID3046891
Molecular FormulaC10H10FNO2
Molecular Weight195.19 g/mol
Exact Mass195.07
IUPAC Name5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one
SMILESO=C1NCC(Cc2ccc(F)cc2)O1
InChIInChI=1S/C10H10FNO2/c11-8-3-1-7(2-4-8)5-9-6-12-10(13)14-9/h1-4,9H,5-6H2,(H,12,13)
InChIKeyYJQGCMLOVNBRLI-UHFFFAOYSA-N
XLogP1.48
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.19
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4R)-4-phenyl-1,3-oxazolidin-2-one
CID 730425
(R)-4-Benzyl-2-oxazolidinone
CID 2734969
5-Phenyl-1,3-oxazolidin-2-one
CID 202193
2-Oxazolidinone, 4-phenyl-, (4S)-
CID 730424
(S)-4-Benzyl-2-oxazolidinone
CID 736225
4-Methyl-5-phenyl-2-oxazolidinone, (4S,5R)-
CID 853161
(5S)-5-phenyl-1,3-oxazolidin-2-one
CID 10855806
(S)-(-)-4-Benzyl-5,5-dimethyl-2-oxazolidinone
CID 10921652
(R)-(+)-4-Benzyl-5,5-dimethyl-2-oxazolidinone
CID 11229494
4-Methyl-5-phenyl-1,3-oxazolidin-2-one
CID 250174
4-Phenyloxazolidin-2-one
CID 349728
(4S,5R)-4-benzyl-5-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-1,3-oxazolidin-2-one
CID 11540938

Frequently Asked Questions

What is the IUPAC name of 5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one?
The IUPAC name of 5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one (CID 3046891) is 5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one is O=C1NCC(Cc2ccc(F)cc2)O1.
What is the InChIKey of 5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one?
The InChIKey is YJQGCMLOVNBRLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO2/c11-8-3-1-7(2-4-8)5-9-6-12-10(13)14-9/h1-4,9H,5-6H2,(H,12,13).
What are the key properties of 5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one?
5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one has a molecular weight of 195.19 g/mol, XLogP of 1.48, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 3046891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).