2-(difluoromethyl)morpholine

C5H9F2NO — CID 68846218

IUPAC2-(difluoromethyl)morpholine
SMILESFC(F)C1CNCCO1
InChIInChI=1S/C5H9F2NO/c6-5(7)4-3-8-1-2-9-4/h4-5,8H,1-3H2
InChIKeyBPZYLTBLBSNUNY-UHFFFAOYSA-N
MW137.13 g/mol
LogP0.24
Rot. Bonds1

About 2-(difluoromethyl)morpholine

2-(difluoromethyl)morpholine (PubChem CID 68846218) has the molecular formula C5H9F2NO and a molecular weight of 137.13 g/mol. Its IUPAC name is 2-(difluoromethyl)morpholine.

Molecular Properties

Compound Name2-(difluoromethyl)morpholine
PubChem CID68846218
Molecular FormulaC5H9F2NO
Molecular Weight137.13 g/mol
Exact Mass137.07
IUPAC Name2-(difluoromethyl)morpholine
SMILESFC(F)C1CNCCO1
InChIInChI=1S/C5H9F2NO/c6-5(7)4-3-8-1-2-9-4/h4-5,8H,1-3H2
InChIKeyBPZYLTBLBSNUNY-UHFFFAOYSA-N
XLogP0.24
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.13
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)morpholine?
The IUPAC name of 2-(difluoromethyl)morpholine (CID 68846218) is 2-(difluoromethyl)morpholine.
What is the SMILES notation for 2-(difluoromethyl)morpholine?
The canonical SMILES for 2-(difluoromethyl)morpholine is FC(F)C1CNCCO1.
What is the InChIKey of 2-(difluoromethyl)morpholine?
The InChIKey is BPZYLTBLBSNUNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F2NO/c6-5(7)4-3-8-1-2-9-4/h4-5,8H,1-3H2.
What are the key properties of 2-(difluoromethyl)morpholine?
2-(difluoromethyl)morpholine has a molecular weight of 137.13 g/mol, XLogP of 0.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)morpholine is sourced from PubChem (CID 68846218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).