2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide

C11H19F3N2O2 — CID 115688437

IUPAC2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide
SMILESCC(NCC1(C)CCCO1)C(=O)NCC(F)(F)F
InChIInChI=1S/C11H19F3N2O2/c1-8(9(17)16-7-11(12,13)14)15-6-10(2)4-3-5-18-10/h8,15H,3-7H2,1-2H3,(H,16,17)
InChIKeyGCYUMAHLVDYAFG-UHFFFAOYSA-N
MW268.28 g/mol
LogP1.21
Rot. Bonds5

About 2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide

2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 115688437) has the molecular formula C11H19F3N2O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is 2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound Name2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID115688437
Molecular FormulaC11H19F3N2O2
Molecular Weight268.28 g/mol
Exact Mass268.14
IUPAC Name2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide
SMILESCC(NCC1(C)CCCO1)C(=O)NCC(F)(F)F
InChIInChI=1S/C11H19F3N2O2/c1-8(9(17)16-7-11(12,13)14)15-6-10(2)4-3-5-18-10/h8,15H,3-7H2,1-2H3,(H,16,17)
InChIKeyGCYUMAHLVDYAFG-UHFFFAOYSA-N
XLogP1.21
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide with MolForge

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

Launch Full Analysis

Related Compounds

2-[(1-methylcyclopropyl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide
CID 103724720
2-(azetidin-3-yl)-N-[(2-methyloxolan-2-yl)methyl]propanamide
CID 116678448
(2S)-2-amino-3,3-dimethyl-N-[(2-methyloxolan-2-yl)methyl]butanamide;hydrochloride
CID 119782236
2-[[2-(methylamino)-2-oxoethyl]amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 115574816
2-(cyclooctylamino)-N-(2,2,2-trifluoroethyl)propanamide
CID 115571393
4,4,4-trifluoro-N-[(2-methyloxolan-2-yl)methyl]butan-1-amine
CID 115513806
2-[(2-methyloxolan-2-yl)methylamino]pentanoic acid
CID 83040810
2-(oxolan-3-ylmethylamino)-N-(2,2,2-trifluoroethyl)propanamide
CID 115581038
2-(1-cyclobutylethylamino)-N-(2,2,2-trifluoroethyl)propanamide
CID 115713799
2-[(3-ethyl-2-hydroxypentyl)amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 106285348
2-(pent-4-ynylamino)-N-(2,2,2-trifluoroethyl)propanamide
CID 103711244
2-[2-(cyclohexen-1-yl)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide
CID 115571067

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of 2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide (CID 115688437) is 2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for 2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for 2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide is CC(NCC1(C)CCCO1)C(=O)NCC(F)(F)F.
What is the InChIKey of 2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is GCYUMAHLVDYAFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O2/c1-8(9(17)16-7-11(12,13)14)15-6-10(2)4-3-5-18-10/h8,15H,3-7H2,1-2H3,(H,16,17).
What are the key properties of 2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide?
2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 268.28 g/mol, XLogP of 1.21, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methyloxolan-2-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 115688437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).