N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide

C8H15F3N2O2 — CID 115869500

IUPACN-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCC(CO)N(C)C(=O)CNCC(F)(F)F
InChIInChI=1S/C8H15F3N2O2/c1-6(4-14)13(2)7(15)3-12-5-8(9,10)11/h6,12,14H,3-5H2,1-2H3
InChIKeySVCIDJXYTMCQFM-UHFFFAOYSA-N
MW228.21 g/mol
LogP-0.02
Rot. Bonds5

About N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide

N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 115869500) has the molecular formula C8H15F3N2O2 and a molecular weight of 228.21 g/mol. Its IUPAC name is N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound NameN-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID115869500
Molecular FormulaC8H15F3N2O2
Molecular Weight228.21 g/mol
Exact Mass228.11
IUPAC NameN-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCC(CO)N(C)C(=O)CNCC(F)(F)F
InChIInChI=1S/C8H15F3N2O2/c1-6(4-14)13(2)7(15)3-12-5-8(9,10)11/h6,12,14H,3-5H2,1-2H3
InChIKeySVCIDJXYTMCQFM-UHFFFAOYSA-N
XLogP-0.02
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
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

N-(1-methoxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 78957945
2-[methyl-[2-(2,2,2-trifluoroethylamino)acetyl]amino]butanoic acid
CID 79261617
N-[1-(2-chlorophenyl)ethyl]-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 78957895
N-[(2R)-1-hydroxypropan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 107218513
N-[2-(diethylamino)-2-oxoethyl]-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 78914738
N-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 79261437
N-(1-hydroxypropan-2-yl)-N-methyl-3-oxobutanamide
CID 104551888
2-(cyclopropylamino)-N-(1-hydroxypropan-2-yl)-N-methylacetamide
CID 104551708
2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide
CID 103461330
N-ethyl-N-(3-hydroxypropyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 115771238
N-methyl-N-[(2-methylcyclopropyl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 79260843
N-(4-hydroxy-3-methylbutan-2-yl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 115770752

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide (CID 115869500) is N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide is CC(CO)N(C)C(=O)CNCC(F)(F)F.
What is the InChIKey of N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is SVCIDJXYTMCQFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F3N2O2/c1-6(4-14)13(2)7(15)3-12-5-8(9,10)11/h6,12,14H,3-5H2,1-2H3.
What are the key properties of N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide?
N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 228.21 g/mol, XLogP of -0.02, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 115869500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).