3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide

C8H15F3N2O2 — CID 103864920

IUPAC3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide
SMILESCNC(=O)CCN(CCO)CC(F)(F)F
InChIInChI=1S/C8H15F3N2O2/c1-12-7(15)2-3-13(4-5-14)6-8(9,10)11/h14H,2-6H2,1H3,(H,12,15)
InChIKeyFFJQDRVIKZVVFK-UHFFFAOYSA-N
MW228.21 g/mol
LogP-0.02
Rot. Bonds6

About 3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide

3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide (PubChem CID 103864920) has the molecular formula C8H15F3N2O2 and a molecular weight of 228.21 g/mol. Its IUPAC name is 3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide.

Molecular Properties

Compound Name3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide
PubChem CID103864920
Molecular FormulaC8H15F3N2O2
Molecular Weight228.21 g/mol
Exact Mass228.11
IUPAC Name3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide
SMILESCNC(=O)CCN(CCO)CC(F)(F)F
InChIInChI=1S/C8H15F3N2O2/c1-12-7(15)2-3-13(4-5-14)6-8(9,10)11/h14H,2-6H2,1H3,(H,12,15)
InChIKeyFFJQDRVIKZVVFK-UHFFFAOYSA-N
XLogP-0.02
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.21
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-1-(4-methylphenyl)propan-1-one
CID 107486425
2-[2,2,2-trifluoroethyl(3,3,3-trifluoropropyl)amino]ethanol
CID 103865004
3-[2-[bis[3-(methylamino)-3-oxopropyl]amino]ethyl-[3-[2-[bis[3-(methylamino)-3-oxopropyl]amino]ethyl-[3-(methylamino)-3-oxopropyl]amino]propyl]amino]-N-methylpropanamide
CID 167153611
3-(dipropylamino)-N-methylpropanamide
CID 90814262
1-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-3-methylbutan-2-one
CID 107481284
2-[2-(propylamino)ethyl-(2,2,2-trifluoroethyl)amino]ethanol
CID 107484786
methyl 4-[[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]amino]butanoate
CID 103864914
4-[[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]amino]butanoic acid
CID 107485886
N-(3,5-difluorophenyl)-3-[3-hydroxypropyl(2,2,2-trifluoroethyl)amino]propanamide
CID 111496349
(2S)-2-[[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]amino]-N-methyl-2-phenylacetamide
CID 97245219
ethyl 4-[[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]amino]butanoate
CID 103864941
3-[2-[bis[3-(methylamino)-3-oxopropyl]amino]ethylamino]-N-methylpropanamide
CID 58105683

Frequently Asked Questions

What is the IUPAC name of 3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide?
The IUPAC name of 3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide (CID 103864920) is 3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide.
What is the SMILES notation for 3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide?
The canonical SMILES for 3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide is CNC(=O)CCN(CCO)CC(F)(F)F.
What is the InChIKey of 3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide?
The InChIKey is FFJQDRVIKZVVFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F3N2O2/c1-12-7(15)2-3-13(4-5-14)6-8(9,10)11/h14H,2-6H2,1H3,(H,12,15).
What are the key properties of 3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide?
3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide has a molecular weight of 228.21 g/mol, XLogP of -0.02, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]-N-methylpropanamide is sourced from PubChem (CID 103864920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).