5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine

C16H17FN2O2 — CID 6454468

IUPAC5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine
SMILESCCOC1CC(c2cccnc2)N(c2ccc(F)cc2)O1
InChIInChI=1S/C16H17FN2O2/c1-2-20-16-10-15(12-4-3-9-18-11-12)19(21-16)14-7-5-13(17)6-8-14/h3-9,11,15-16H,2,10H2,1H3
InChIKeyVFGZKKHJKBMBDI-UHFFFAOYSA-N
MW288.32 g/mol
LogP3.47
Rot. Bonds4

About 5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine

5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine (PubChem CID 6454468) has the molecular formula C16H17FN2O2 and a molecular weight of 288.32 g/mol. Its IUPAC name is 5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine.

Molecular Properties

Compound Name5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine
PubChem CID6454468
Molecular FormulaC16H17FN2O2
Molecular Weight288.32 g/mol
Exact Mass288.13
IUPAC Name5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine
SMILESCCOC1CC(c2cccnc2)N(c2ccc(F)cc2)O1
InChIInChI=1S/C16H17FN2O2/c1-2-20-16-10-15(12-4-3-9-18-11-12)19(21-16)14-7-5-13(17)6-8-14/h3-9,11,15-16H,2,10H2,1H3
InChIKeyVFGZKKHJKBMBDI-UHFFFAOYSA-N
XLogP3.47
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.32
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine?
The IUPAC name of 5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine (CID 6454468) is 5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine.
What is the SMILES notation for 5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine?
The canonical SMILES for 5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine is CCOC1CC(c2cccnc2)N(c2ccc(F)cc2)O1.
What is the InChIKey of 5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine?
The InChIKey is VFGZKKHJKBMBDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O2/c1-2-20-16-10-15(12-4-3-9-18-11-12)19(21-16)14-7-5-13(17)6-8-14/h3-9,11,15-16H,2,10H2,1H3.
What are the key properties of 5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine?
5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine has a molecular weight of 288.32 g/mol, XLogP of 3.47, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-2-(4-fluorophenyl)-3-pyridin-3-yl-1,2-oxazolidine is sourced from PubChem (CID 6454468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).