2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide

C8H14F3NO2 — CID 166470940

IUPAC2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCOC(C)C(=O)N(C)CC(F)(F)F
InChIInChI=1S/C8H14F3NO2/c1-4-14-6(2)7(13)12(3)5-8(9,10)11/h6H,4-5H2,1-3H3
InChIKeyPBMVJHANTOQIEY-UHFFFAOYSA-N
MW213.20 g/mol
LogP1.43
Rot. Bonds4

About 2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide

2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 166470940) has the molecular formula C8H14F3NO2 and a molecular weight of 213.20 g/mol. Its IUPAC name is 2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound Name2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID166470940
Molecular FormulaC8H14F3NO2
Molecular Weight213.20 g/mol
Exact Mass213.10
IUPAC Name2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCOC(C)C(=O)N(C)CC(F)(F)F
InChIInChI=1S/C8H14F3NO2/c1-4-14-6(2)7(13)12(3)5-8(9,10)11/h6H,4-5H2,1-3H3
InChIKeyPBMVJHANTOQIEY-UHFFFAOYSA-N
XLogP1.43
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.20
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3,3,3-Tetrafluoro-2-(heptafluoropropoxy)-1-(morpholin-4-yl)propan-1-one
CID 3457661
N,N-Diethyl-2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]propanamide
CID 71672887
N,N-Diethyl-2,3,3,3-tetrafluoro-2-(heptafluoropropoxy)propanamide
CID 71672900
4-(2,3,3,3-Tetrafluoro-2-methoxypropanoyl)morpholine
CID 2828738
1-Piperidin-1-yl-2-(2,2,2-trifluoroethoxy)propan-1-one
CID 45887316
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
1-(4-Acetylpiperazin-1-yl)-2-(2,2,2-trifluoroethoxy)propan-1-one
CID 45887347
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
N,N-diethyl-2-fluoro-2-heptafluoropropoxyacet-amide
CID 100977959
N,N-bis(2-hydroxyethyl)-perfluoro-2-methyl-3-oxa-hexanamide
CID 134694506

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of 2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide (CID 166470940) is 2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for 2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for 2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide is CCOC(C)C(=O)N(C)CC(F)(F)F.
What is the InChIKey of 2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is PBMVJHANTOQIEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO2/c1-4-14-6(2)7(13)12(3)5-8(9,10)11/h6H,4-5H2,1-3H3.
What are the key properties of 2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide?
2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 213.20 g/mol, XLogP of 1.43, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-methyl-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 166470940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).