2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide

C10H20F3N3O — CID 54939878

IUPAC2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESCN(C)C(C)(C)CNCC(=O)NCC(F)(F)F
InChIInChI=1S/C10H20F3N3O/c1-9(2,16(3)4)6-14-5-8(17)15-7-10(11,12)13/h14H,5-7H2,1-4H3,(H,15,17)
InChIKeyPNVMPWZHBJUIIC-UHFFFAOYSA-N
MW255.28 g/mol
LogP0.59
Rot. Bonds6

About 2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide

2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 54939878) has the molecular formula C10H20F3N3O and a molecular weight of 255.28 g/mol. Its IUPAC name is 2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID54939878
Molecular FormulaC10H20F3N3O
Molecular Weight255.28 g/mol
Exact Mass255.16
IUPAC Name2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESCN(C)C(C)(C)CNCC(=O)NCC(F)(F)F
InChIInChI=1S/C10H20F3N3O/c1-9(2,16(3)4)6-14-5-8(17)15-7-10(11,12)13/h14H,5-7H2,1-4H3,(H,15,17)
InChIKeyPNVMPWZHBJUIIC-UHFFFAOYSA-N
XLogP0.59
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Acetamide, 2-(diethylamino)-N-tert-pentyl-, hydrochloride
CID 60313
Acetamide, N-tert-butyl-2-(diethylamino)-, hydrochloride
CID 60441
N1-isobutyl-N2-(2,2,2-trifluoroethyl)oxalamide
CID 45585739
N-cyclopropyl-2-[2,2-dimethyl-4-(2,2,2-trifluoroethyl)piperazin-1-yl]acetamide
CID 84598300
2-[2,2-Dimethyl-4-(2,2,2-trifluoroethyl)piperazin-1-yl]acetamide
CID 84598862
1,2-Diaminoethane, N-trifluoroacetyl-2,2-dimethyl-
CID 546891
2-amino-N-ethyl-3,3,3-trifluoro-2-methylpropanamide
CID 79789707
2-[acetyl(methyl)amino]-N-tert-butylacetamide
CID 60717614
N-tert-butyl-2-[butyl(2,2,2-trifluoroethyl)amino]acetamide
CID 56788582
2-(2,2-dimethylpyrrolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 72044880
5,5-Dimethyl-4-(3,3,3-trifluoropropanoyl)piperazin-2-one
CID 119051597
N-[3,3,3-trifluoro-2-methyl-2-(propanoylamino)propyl]propanamide
CID 119052926

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide (CID 54939878) is 2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide is CN(C)C(C)(C)CNCC(=O)NCC(F)(F)F.
What is the InChIKey of 2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is PNVMPWZHBJUIIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F3N3O/c1-9(2,16(3)4)6-14-5-8(17)15-7-10(11,12)13/h14H,5-7H2,1-4H3,(H,15,17).
What are the key properties of 2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide?
2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 255.28 g/mol, XLogP of 0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 54939878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).