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

C10H12FNO — CID 86236808

IUPAC3-[(2-fluorophenyl)methyl]-1,3-oxazolidine
SMILESFc1ccccc1CN1CCOC1
InChIInChI=1S/C10H12FNO/c11-10-4-2-1-3-9(10)7-12-5-6-13-8-12/h1-4H,5-8H2
InChIKeyFPAVNRJKXAAOCY-UHFFFAOYSA-N
MW181.21 g/mol
LogP1.62
Rot. Bonds2

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

3-[(2-fluorophenyl)methyl]-1,3-oxazolidine (PubChem CID 86236808) has the molecular formula C10H12FNO and a molecular weight of 181.21 g/mol. Its IUPAC name is 3-[(2-fluorophenyl)methyl]-1,3-oxazolidine.

Molecular Properties

Compound Name3-[(2-fluorophenyl)methyl]-1,3-oxazolidine
PubChem CID86236808
Molecular FormulaC10H12FNO
Molecular Weight181.21 g/mol
Exact Mass181.09
IUPAC Name3-[(2-fluorophenyl)methyl]-1,3-oxazolidine
SMILESFc1ccccc1CN1CCOC1
InChIInChI=1S/C10H12FNO/c11-10-4-2-1-3-9(10)7-12-5-6-13-8-12/h1-4H,5-8H2
InChIKeyFPAVNRJKXAAOCY-UHFFFAOYSA-N
XLogP1.62
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 51.62
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]-1,3-oxazolidine?
The IUPAC name of 3-[(2-fluorophenyl)methyl]-1,3-oxazolidine (CID 86236808) is 3-[(2-fluorophenyl)methyl]-1,3-oxazolidine.
What is the SMILES notation for 3-[(2-fluorophenyl)methyl]-1,3-oxazolidine?
The canonical SMILES for 3-[(2-fluorophenyl)methyl]-1,3-oxazolidine is Fc1ccccc1CN1CCOC1.
What is the InChIKey of 3-[(2-fluorophenyl)methyl]-1,3-oxazolidine?
The InChIKey is FPAVNRJKXAAOCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO/c11-10-4-2-1-3-9(10)7-12-5-6-13-8-12/h1-4H,5-8H2.
What are the key properties of 3-[(2-fluorophenyl)methyl]-1,3-oxazolidine?
3-[(2-fluorophenyl)methyl]-1,3-oxazolidine has a molecular weight of 181.21 g/mol, XLogP of 1.62, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-fluorophenyl)methyl]-1,3-oxazolidine is sourced from PubChem (CID 86236808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).