2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide

C11H20F3NO3 — CID 164667442

IUPAC2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide
SMILESCOC(C)C(=O)N(C)C(OCC(F)(F)F)C(C)C
InChIInChI=1S/C11H20F3NO3/c1-7(2)10(18-6-11(12,13)14)15(4)9(16)8(3)17-5/h7-8,10H,6H2,1-5H3
InChIKeyGZYOZIZLJXHBTM-UHFFFAOYSA-N
MW271.28 g/mol
LogP2.04
Rot. Bonds6

About 2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide

2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide (PubChem CID 164667442) has the molecular formula C11H20F3NO3 and a molecular weight of 271.28 g/mol. Its IUPAC name is 2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide.

Molecular Properties

Compound Name2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide
PubChem CID164667442
Molecular FormulaC11H20F3NO3
Molecular Weight271.28 g/mol
Exact Mass271.14
IUPAC Name2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide
SMILESCOC(C)C(=O)N(C)C(OCC(F)(F)F)C(C)C
InChIInChI=1S/C11H20F3NO3/c1-7(2)10(18-6-11(12,13)14)15(4)9(16)8(3)17-5/h7-8,10H,6H2,1-5H3
InChIKeyGZYOZIZLJXHBTM-UHFFFAOYSA-N
XLogP2.04
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.28
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-Pyrrolidin-1-yl-2-(2,2,2-trifluoroethoxy)propan-1-one
CID 45887329
1-Morpholin-4-yl-2-(2,2,2-trifluoroethoxy)propan-1-one
CID 45887346
2-(difluoromethoxy)-1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethan-1-one
CID 126771662
2-methoxy-N-methyl-N-[1-(2,2,2-trifluoroethoxy)propyl]propanamide
CID 10801125
1-(2,6-Dimethylmorpholin-4-yl)-2-(2,2,2-trifluoroethoxy)ethanone
CID 45893146
2-methoxy-N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide
CID 58544138
methane;2-methoxy-N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide
CID 161504445
2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide
CID 166470940
N-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide
CID 170040616
2-propoxy-N,N-dipropylpropanamide
CID 87338040
N-methyl-2-(2,2,2-trifluoroethoxy)-N-[1-(2,2,2-trifluoroethoxy)propyl]propanamide
CID 10592116
2-methoxy-N-methyl-N-[1-(2,2,2-trifluoroethoxy)butyl]propanamide
CID 10778511

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide?
The IUPAC name of 2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide (CID 164667442) is 2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide.
What is the SMILES notation for 2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide?
The canonical SMILES for 2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide is COC(C)C(=O)N(C)C(OCC(F)(F)F)C(C)C.
What is the InChIKey of 2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide?
The InChIKey is GZYOZIZLJXHBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3NO3/c1-7(2)10(18-6-11(12,13)14)15(4)9(16)8(3)17-5/h7-8,10H,6H2,1-5H3.
What are the key properties of 2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide?
2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide has a molecular weight of 271.28 g/mol, XLogP of 2.04, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-N-[2-methyl-1-(2,2,2-trifluoroethoxy)propyl]propanamide is sourced from PubChem (CID 164667442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).