2-(difluoromethyl)-6-methylmorpholine

C6H11F2NO — CID 130618699

IUPAC2-(difluoromethyl)-6-methylmorpholine
SMILESCC1CNCC(C(F)F)O1
InChIInChI=1S/C6H11F2NO/c1-4-2-9-3-5(10-4)6(7)8/h4-6,9H,2-3H2,1H3
InChIKeyLLRIRMCGVZWYCC-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.63
Rot. Bonds1

About 2-(difluoromethyl)-6-methylmorpholine

2-(difluoromethyl)-6-methylmorpholine (PubChem CID 130618699) has the molecular formula C6H11F2NO and a molecular weight of 151.16 g/mol. Its IUPAC name is 2-(difluoromethyl)-6-methylmorpholine.

Molecular Properties

Compound Name2-(difluoromethyl)-6-methylmorpholine
PubChem CID130618699
Molecular FormulaC6H11F2NO
Molecular Weight151.16 g/mol
Exact Mass151.08
IUPAC Name2-(difluoromethyl)-6-methylmorpholine
SMILESCC1CNCC(C(F)F)O1
InChIInChI=1S/C6H11F2NO/c1-4-2-9-3-5(10-4)6(7)8/h4-6,9H,2-3H2,1H3
InChIKeyLLRIRMCGVZWYCC-UHFFFAOYSA-N
XLogP0.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-6-methylmorpholine?
The IUPAC name of 2-(difluoromethyl)-6-methylmorpholine (CID 130618699) is 2-(difluoromethyl)-6-methylmorpholine.
What is the SMILES notation for 2-(difluoromethyl)-6-methylmorpholine?
The canonical SMILES for 2-(difluoromethyl)-6-methylmorpholine is CC1CNCC(C(F)F)O1.
What is the InChIKey of 2-(difluoromethyl)-6-methylmorpholine?
The InChIKey is LLRIRMCGVZWYCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2NO/c1-4-2-9-3-5(10-4)6(7)8/h4-6,9H,2-3H2,1H3.
What are the key properties of 2-(difluoromethyl)-6-methylmorpholine?
2-(difluoromethyl)-6-methylmorpholine has a molecular weight of 151.16 g/mol, XLogP of 0.63, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-6-methylmorpholine is sourced from PubChem (CID 130618699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).