N-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide

C11H18F3N3O3 — CID 66266806

IUPACN-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)N(C)CC(=O)NCC(F)(F)F
InChIInChI=1S/C11H18F3N3O3/c1-15-8-5-20-4-7(8)10(19)17(2)3-9(18)16-6-11(12,13)14/h7-8,15H,3-6H2,1-2H3,(H,16,18)
InChIKeyVWQAZDHXINLXRH-UHFFFAOYSA-N
MW297.28 g/mol
LogP-0.64
Rot. Bonds5

About N-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide

N-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide (PubChem CID 66266806) has the molecular formula C11H18F3N3O3 and a molecular weight of 297.28 g/mol. Its IUPAC name is N-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide.

Molecular Properties

Compound NameN-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide
PubChem CID66266806
Molecular FormulaC11H18F3N3O3
Molecular Weight297.28 g/mol
Exact Mass297.13
IUPAC NameN-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)N(C)CC(=O)NCC(F)(F)F
InChIInChI=1S/C11H18F3N3O3/c1-15-8-5-20-4-7(8)10(19)17(2)3-9(18)16-6-11(12,13)14/h7-8,15H,3-6H2,1-2H3,(H,16,18)
InChIKeyVWQAZDHXINLXRH-UHFFFAOYSA-N
XLogP-0.64
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.28
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide 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 N-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide?
The IUPAC name of N-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide (CID 66266806) is N-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide.
What is the SMILES notation for N-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide?
The canonical SMILES for N-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide is CNC1COCC1C(=O)N(C)CC(=O)NCC(F)(F)F.
What is the InChIKey of N-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide?
The InChIKey is VWQAZDHXINLXRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18F3N3O3/c1-15-8-5-20-4-7(8)10(19)17(2)3-9(18)16-6-11(12,13)14/h7-8,15H,3-6H2,1-2H3,(H,16,18).
What are the key properties of N-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide?
N-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide has a molecular weight of 297.28 g/mol, XLogP of -0.64, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(methylamino)-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]oxolane-3-carboxamide is sourced from PubChem (CID 66266806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).