4-methyl-2-(trifluoromethyl)morpholine

C6H10F3NO — CID 89212747

IUPAC4-methyl-2-(trifluoromethyl)morpholine
SMILESCN1CCOC(C(F)(F)F)C1
InChIInChI=1S/C6H10F3NO/c1-10-2-3-11-5(4-10)6(7,8)9/h5H,2-4H2,1H3
InChIKeyWNVDCNRTXADRQK-UHFFFAOYSA-N
MW169.15 g/mol
LogP0.88
Rot. Bonds

About 4-methyl-2-(trifluoromethyl)morpholine

4-methyl-2-(trifluoromethyl)morpholine (PubChem CID 89212747) has the molecular formula C6H10F3NO and a molecular weight of 169.15 g/mol. Its IUPAC name is 4-methyl-2-(trifluoromethyl)morpholine.

Molecular Properties

Compound Name4-methyl-2-(trifluoromethyl)morpholine
PubChem CID89212747
Molecular FormulaC6H10F3NO
Molecular Weight169.15 g/mol
Exact Mass169.07
IUPAC Name4-methyl-2-(trifluoromethyl)morpholine
SMILESCN1CCOC(C(F)(F)F)C1
InChIInChI=1S/C6H10F3NO/c1-10-2-3-11-5(4-10)6(7,8)9/h5H,2-4H2,1H3
InChIKeyWNVDCNRTXADRQK-UHFFFAOYSA-N
XLogP0.88
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.15
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(trifluoromethyl)morpholine?
The IUPAC name of 4-methyl-2-(trifluoromethyl)morpholine (CID 89212747) is 4-methyl-2-(trifluoromethyl)morpholine.
What is the SMILES notation for 4-methyl-2-(trifluoromethyl)morpholine?
The canonical SMILES for 4-methyl-2-(trifluoromethyl)morpholine is CN1CCOC(C(F)(F)F)C1.
What is the InChIKey of 4-methyl-2-(trifluoromethyl)morpholine?
The InChIKey is WNVDCNRTXADRQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F3NO/c1-10-2-3-11-5(4-10)6(7,8)9/h5H,2-4H2,1H3.
What are the key properties of 4-methyl-2-(trifluoromethyl)morpholine?
4-methyl-2-(trifluoromethyl)morpholine has a molecular weight of 169.15 g/mol, XLogP of 0.88, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(trifluoromethyl)morpholine is sourced from PubChem (CID 89212747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).