3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine

C16H16FNO — CID 138756957

IUPAC3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine
SMILESFc1ccccc1CN1COC(c2ccccc2)C1
InChIInChI=1S/C16H16FNO/c17-15-9-5-4-8-14(15)10-18-11-16(19-12-18)13-6-2-1-3-7-13/h1-9,16H,10-12H2
InChIKeyLHSJKTNADUMRBX-UHFFFAOYSA-N
MW257.31 g/mol
LogP3.36
Rot. Bonds3

About 3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine

3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine (PubChem CID 138756957) has the molecular formula C16H16FNO and a molecular weight of 257.31 g/mol. Its IUPAC name is 3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine.

Molecular Properties

Compound Name3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine
PubChem CID138756957
Molecular FormulaC16H16FNO
Molecular Weight257.31 g/mol
Exact Mass257.12
IUPAC Name3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine
SMILESFc1ccccc1CN1COC(c2ccccc2)C1
InChIInChI=1S/C16H16FNO/c17-15-9-5-4-8-14(15)10-18-11-16(19-12-18)13-6-2-1-3-7-13/h1-9,16H,10-12H2
InChIKeyLHSJKTNADUMRBX-UHFFFAOYSA-N
XLogP3.36
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine?
The IUPAC name of 3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine (CID 138756957) is 3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine.
What is the SMILES notation for 3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine?
The canonical SMILES for 3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine is Fc1ccccc1CN1COC(c2ccccc2)C1.
What is the InChIKey of 3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine?
The InChIKey is LHSJKTNADUMRBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO/c17-15-9-5-4-8-14(15)10-18-11-16(19-12-18)13-6-2-1-3-7-13/h1-9,16H,10-12H2.
What are the key properties of 3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine?
3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine has a molecular weight of 257.31 g/mol, XLogP of 3.36, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-fluorophenyl)methyl]-5-phenyl-1,3-oxazolidine is sourced from PubChem (CID 138756957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).