7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine

C13H11FN2O — CID 90992894

IUPAC7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine
SMILESFc1cccc(-c2cnc3c(c2)NCCO3)c1
InChIInChI=1S/C13H11FN2O/c14-11-3-1-2-9(6-11)10-7-12-13(16-8-10)17-5-4-15-12/h1-3,6-8,15H,4-5H2
InChIKeyDIZFXSKVTDWTKH-UHFFFAOYSA-N
MW230.24 g/mol
LogP2.69
Rot. Bonds1

About 7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine

7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine (PubChem CID 90992894) has the molecular formula C13H11FN2O and a molecular weight of 230.24 g/mol. Its IUPAC name is 7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine.

Molecular Properties

Compound Name7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine
PubChem CID90992894
Molecular FormulaC13H11FN2O
Molecular Weight230.24 g/mol
Exact Mass230.09
IUPAC Name7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine
SMILESFc1cccc(-c2cnc3c(c2)NCCO3)c1
InChIInChI=1S/C13H11FN2O/c14-11-3-1-2-9(6-11)10-7-12-13(16-8-10)17-5-4-15-12/h1-3,6-8,15H,4-5H2
InChIKeyDIZFXSKVTDWTKH-UHFFFAOYSA-N
XLogP2.69
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.24
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine?
The IUPAC name of 7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine (CID 90992894) is 7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine.
What is the SMILES notation for 7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine?
The canonical SMILES for 7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine is Fc1cccc(-c2cnc3c(c2)NCCO3)c1.
What is the InChIKey of 7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine?
The InChIKey is DIZFXSKVTDWTKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O/c14-11-3-1-2-9(6-11)10-7-12-13(16-8-10)17-5-4-15-12/h1-3,6-8,15H,4-5H2.
What are the key properties of 7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine?
7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine has a molecular weight of 230.24 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-fluorophenyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine is sourced from PubChem (CID 90992894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).