4-(3-bromo-5-fluorophenyl)morpholine

C10H11BrFNO — CID 44627366

IUPAC4-(3-bromo-5-fluorophenyl)morpholine
SMILESFc1cc(Br)cc(N2CCOCC2)c1
InChIInChI=1S/C10H11BrFNO/c11-8-5-9(12)7-10(6-8)13-1-3-14-4-2-13/h5-7H,1-4H2
InChIKeyUHXYWHREXXDPCB-UHFFFAOYSA-N
MW260.11 g/mol
LogP2.42
Rot. Bonds1

About 4-(3-bromo-5-fluorophenyl)morpholine

4-(3-bromo-5-fluorophenyl)morpholine (PubChem CID 44627366) has the molecular formula C10H11BrFNO and a molecular weight of 260.11 g/mol. Its IUPAC name is 4-(3-bromo-5-fluorophenyl)morpholine.

Molecular Properties

Compound Name4-(3-bromo-5-fluorophenyl)morpholine
PubChem CID44627366
Molecular FormulaC10H11BrFNO
Molecular Weight260.11 g/mol
Exact Mass259.00
IUPAC Name4-(3-bromo-5-fluorophenyl)morpholine
SMILESFc1cc(Br)cc(N2CCOCC2)c1
InChIInChI=1S/C10H11BrFNO/c11-8-5-9(12)7-10(6-8)13-1-3-14-4-2-13/h5-7H,1-4H2
InChIKeyUHXYWHREXXDPCB-UHFFFAOYSA-N
XLogP2.42
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.11
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3-bromo-5-fluorophenyl)morpholine?
The IUPAC name of 4-(3-bromo-5-fluorophenyl)morpholine (CID 44627366) is 4-(3-bromo-5-fluorophenyl)morpholine.
What is the SMILES notation for 4-(3-bromo-5-fluorophenyl)morpholine?
The canonical SMILES for 4-(3-bromo-5-fluorophenyl)morpholine is Fc1cc(Br)cc(N2CCOCC2)c1.
What is the InChIKey of 4-(3-bromo-5-fluorophenyl)morpholine?
The InChIKey is UHXYWHREXXDPCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrFNO/c11-8-5-9(12)7-10(6-8)13-1-3-14-4-2-13/h5-7H,1-4H2.
What are the key properties of 4-(3-bromo-5-fluorophenyl)morpholine?
4-(3-bromo-5-fluorophenyl)morpholine has a molecular weight of 260.11 g/mol, XLogP of 2.42, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-bromo-5-fluorophenyl)morpholine is sourced from PubChem (CID 44627366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).