2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide

C15H24F3N3O3 — CID 78788327

IUPAC2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide
SMILESCC(C(=O)NCC(F)(F)F)N1CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C15H24F3N3O3/c1-11(13(22)19-10-15(16,17)18)20-4-2-12(3-5-20)14(23)21-6-8-24-9-7-21/h11-12H,2-10H2,1H3,(H,19,22)
InChIKeyLISJQXFBPDYBLZ-UHFFFAOYSA-N
MW351.37 g/mol
LogP0.62
Rot. Bonds4

About 2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide

2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 78788327) has the molecular formula C15H24F3N3O3 and a molecular weight of 351.37 g/mol. Its IUPAC name is 2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound Name2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID78788327
Molecular FormulaC15H24F3N3O3
Molecular Weight351.37 g/mol
Exact Mass351.18
IUPAC Name2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide
SMILESCC(C(=O)NCC(F)(F)F)N1CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C15H24F3N3O3/c1-11(13(22)19-10-15(16,17)18)20-4-2-12(3-5-20)14(23)21-6-8-24-9-7-21/h11-12H,2-10H2,1H3,(H,19,22)
InChIKeyLISJQXFBPDYBLZ-UHFFFAOYSA-N
XLogP0.62
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.37
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of 2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide (CID 78788327) is 2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for 2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for 2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide is CC(C(=O)NCC(F)(F)F)N1CCC(C(=O)N2CCOCC2)CC1.
What is the InChIKey of 2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is LISJQXFBPDYBLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24F3N3O3/c1-11(13(22)19-10-15(16,17)18)20-4-2-12(3-5-20)14(23)21-6-8-24-9-7-21/h11-12H,2-10H2,1H3,(H,19,22).
What are the key properties of 2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide?
2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 351.37 g/mol, XLogP of 0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 78788327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).