4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine

C7H8F7NO — CID 54297752

IUPAC4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine
SMILESFC(F)(F)C(F)(N1CCOCC1)C(F)(F)F
InChIInChI=1S/C7H8F7NO/c8-5(6(9,10)11,7(12,13)14)15-1-3-16-4-2-15/h1-4H2
InChIKeySBZBSJMIHAQJMK-UHFFFAOYSA-N
MW255.13 g/mol
LogP2.11
Rot. Bonds1

About 4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine

4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine (PubChem CID 54297752) has the molecular formula C7H8F7NO and a molecular weight of 255.13 g/mol. Its IUPAC name is 4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine.

Molecular Properties

Compound Name4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine
PubChem CID54297752
Molecular FormulaC7H8F7NO
Molecular Weight255.13 g/mol
Exact Mass255.05
IUPAC Name4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine
SMILESFC(F)(F)C(F)(N1CCOCC1)C(F)(F)F
InChIInChI=1S/C7H8F7NO/c8-5(6(9,10)11,7(12,13)14)15-1-3-16-4-2-15/h1-4H2
InChIKeySBZBSJMIHAQJMK-UHFFFAOYSA-N
XLogP2.11
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.13
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze 4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)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 4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine?
The IUPAC name of 4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine (CID 54297752) is 4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine.
What is the SMILES notation for 4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine?
The canonical SMILES for 4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine is FC(F)(F)C(F)(N1CCOCC1)C(F)(F)F.
What is the InChIKey of 4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine?
The InChIKey is SBZBSJMIHAQJMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F7NO/c8-5(6(9,10)11,7(12,13)14)15-1-3-16-4-2-15/h1-4H2.
What are the key properties of 4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine?
4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine has a molecular weight of 255.13 g/mol, XLogP of 2.11, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)morpholine is sourced from PubChem (CID 54297752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).