5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine

C10H10FNO — CID 66641810

IUPAC5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine
SMILESFc1ccc(C2=NCCOC2)cc1
InChIInChI=1S/C10H10FNO/c11-9-3-1-8(2-4-9)10-7-13-6-5-12-10/h1-4H,5-7H2
InChIKeySKSVKKOMMUDAGM-UHFFFAOYSA-N
MW179.19 g/mol
LogP1.64
Rot. Bonds1

About 5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine

5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine (PubChem CID 66641810) has the molecular formula C10H10FNO and a molecular weight of 179.19 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine.

Molecular Properties

Compound Name5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine
PubChem CID66641810
Molecular FormulaC10H10FNO
Molecular Weight179.19 g/mol
Exact Mass179.07
IUPAC Name5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine
SMILESFc1ccc(C2=NCCOC2)cc1
InChIInChI=1S/C10H10FNO/c11-9-3-1-8(2-4-9)10-7-13-6-5-12-10/h1-4H,5-7H2
InChIKeySKSVKKOMMUDAGM-UHFFFAOYSA-N
XLogP1.64
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.19
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine?
The IUPAC name of 5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine (CID 66641810) is 5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine.
What is the SMILES notation for 5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine?
The canonical SMILES for 5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine is Fc1ccc(C2=NCCOC2)cc1.
What is the InChIKey of 5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine?
The InChIKey is SKSVKKOMMUDAGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO/c11-9-3-1-8(2-4-9)10-7-13-6-5-12-10/h1-4H,5-7H2.
What are the key properties of 5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine?
5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine has a molecular weight of 179.19 g/mol, XLogP of 1.64, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-3,6-dihydro-2H-1,4-oxazine is sourced from PubChem (CID 66641810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).