N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide

C10H17F3N2O2 — CID 60778817

IUPACN-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCC(C)C(=O)N(CC(=O)N(C)C)CC(F)(F)F
InChIInChI=1S/C10H17F3N2O2/c1-7(2)9(17)15(6-10(11,12)13)5-8(16)14(3)4/h7H,5-6H2,1-4H3
InChIKeyZCUSECAORNGFQF-UHFFFAOYSA-N
MW254.25 g/mol
LogP1.12
Rot. Bonds4

About N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide

N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 60778817) has the molecular formula C10H17F3N2O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID60778817
Molecular FormulaC10H17F3N2O2
Molecular Weight254.25 g/mol
Exact Mass254.12
IUPAC NameN-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCC(C)C(=O)N(CC(=O)N(C)C)CC(F)(F)F
InChIInChI=1S/C10H17F3N2O2/c1-7(2)9(17)15(6-10(11,12)13)5-8(16)14(3)4/h7H,5-6H2,1-4H3
InChIKeyZCUSECAORNGFQF-UHFFFAOYSA-N
XLogP1.12
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Methyl-1-[4-(2,2,2-trifluoroacetyl)piperazin-1-yl]propan-1-one
CID 62734854
2-Methyl-1-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]propan-1-one
CID 49718239
2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide
CID 60766412
N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide
CID 60766679
N-[2-(dimethylamino)-2-oxoethyl]-N-(2,2,2-trifluoroethyl)butanamide
CID 60778774
2-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]propanamide
CID 123793801
4-(2,2-Dimethylpropanoyl)-1-(2,2,2-trifluoroethyl)piperazin-2-one
CID 126750449
N,N-diethylpropanamide;ethane;N-methyl-N-(2,2,2-trifluoroethyl)propanamide
CID 142518884
Ethane;2-methyl-1-[4-(3,3,3-trifluoropropyl)piperazin-1-yl]propan-1-one
CID 145287236
Ethane;2-methyl-1-[4-(3,3,3-trifluoropropyl)-1,4-diazepan-1-yl]propan-1-one
CID 145287286
2-[(1-fluoro-2-methylpropyl)-methylamino]-N-methyl-N-(2-methylpropyl)acetamide
CID 165035074
2-[(1,1-difluoro-2-methylpropyl)-methylamino]-N-methyl-N-(2-methylpropyl)acetamide
CID 165035075

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide (CID 60778817) is N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide is CC(C)C(=O)N(CC(=O)N(C)C)CC(F)(F)F.
What is the InChIKey of N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is ZCUSECAORNGFQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O2/c1-7(2)9(17)15(6-10(11,12)13)5-8(16)14(3)4/h7H,5-6H2,1-4H3.
What are the key properties of N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide?
N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 254.25 g/mol, XLogP of 1.12, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 60778817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).