3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine

C10H19F2NO2 — CID 137419274

IUPAC3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine
SMILESCC(C)CN1CCOCC1COC(F)F
InChIInChI=1S/C10H19F2NO2/c1-8(2)5-13-3-4-14-6-9(13)7-15-10(11)12/h8-10H,3-7H2,1-2H3
InChIKeyYHOVHLOKLMXUHQ-UHFFFAOYSA-N
MW223.26 g/mol
LogP1.58
Rot. Bonds5

About 3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine

3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine (PubChem CID 137419274) has the molecular formula C10H19F2NO2 and a molecular weight of 223.26 g/mol. Its IUPAC name is 3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine.

Molecular Properties

Compound Name3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine
PubChem CID137419274
Molecular FormulaC10H19F2NO2
Molecular Weight223.26 g/mol
Exact Mass223.14
IUPAC Name3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine
SMILESCC(C)CN1CCOCC1COC(F)F
InChIInChI=1S/C10H19F2NO2/c1-8(2)5-13-3-4-14-6-9(13)7-15-10(11)12/h8-10H,3-7H2,1-2H3
InChIKeyYHOVHLOKLMXUHQ-UHFFFAOYSA-N
XLogP1.58
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.26
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine?
The IUPAC name of 3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine (CID 137419274) is 3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine.
What is the SMILES notation for 3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine?
The canonical SMILES for 3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine is CC(C)CN1CCOCC1COC(F)F.
What is the InChIKey of 3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine?
The InChIKey is YHOVHLOKLMXUHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F2NO2/c1-8(2)5-13-3-4-14-6-9(13)7-15-10(11)12/h8-10H,3-7H2,1-2H3.
What are the key properties of 3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine?
3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine has a molecular weight of 223.26 g/mol, XLogP of 1.58, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethoxymethyl)-4-(2-methylpropyl)morpholine is sourced from PubChem (CID 137419274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).