N-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide

C9H15F3N2O2 — CID 115689578

IUPACN-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCN(CC(F)(F)F)C(=O)CNC1CCOC1
InChIInChI=1S/C9H15F3N2O2/c1-14(6-9(10,11)12)8(15)4-13-7-2-3-16-5-7/h7,13H,2-6H2,1H3
InChIKeyGFVTXQLLDCPSKL-UHFFFAOYSA-N
MW240.22 g/mol
LogP0.39
Rot. Bonds4

About N-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide

N-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 115689578) has the molecular formula C9H15F3N2O2 and a molecular weight of 240.22 g/mol. Its IUPAC name is N-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound NameN-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID115689578
Molecular FormulaC9H15F3N2O2
Molecular Weight240.22 g/mol
Exact Mass240.11
IUPAC NameN-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCN(CC(F)(F)F)C(=O)CNC1CCOC1
InChIInChI=1S/C9H15F3N2O2/c1-14(6-9(10,11)12)8(15)4-13-7-2-3-16-5-7/h7,13H,2-6H2,1H3
InChIKeyGFVTXQLLDCPSKL-UHFFFAOYSA-N
XLogP0.39
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.22
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(2-methoxyethyl)-3-methylpiperazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 53609803
2-(Methoxymethyl)-1-(trifluoroacetyl)piperazine
CID 21295713
2,2,2-trifluoro-N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]acetamide
CID 122605534
N-(1-amino-3-ethoxypropan-2-yl)-2,2,2-trifluoroacetamide
CID 156761445
2-[[2-[3-(Trifluoromethoxy)pyrrolidin-1-yl]acetyl]amino]propanamide
CID 176272224
2,2,2-trifluoro-N-[(3S,4S)-4-[(2,2,2-trifluoroacetyl)amino]oxolan-3-yl]acetamide
CID 21796811
1-Morpholin-4-yl-2-(2,2,2-trifluoroethylamino)propan-1-one
CID 43089166
N-(2-methoxyethyl)-2-(2,2,2-trifluoroethylamino)propanamide
CID 43089172
(2S,4S)-3-acetyl-N-methyl-2-(trifluoromethyl)-1,3-oxazolidine-4-carboxamide
CID 46844713
(2R,4S)-3-acetyl-N-methyl-2-(trifluoromethyl)-1,3-oxazolidine-4-carboxamide
CID 46844839
2-[4-(2-ethoxyethyl)piperazin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide
CID 53611026
N-(3-ethoxypropyl)-2-(propan-2-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 54871761

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of N-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide (CID 115689578) is N-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for N-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for N-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide is CN(CC(F)(F)F)C(=O)CNC1CCOC1.
What is the InChIKey of N-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is GFVTXQLLDCPSKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F3N2O2/c1-14(6-9(10,11)12)8(15)4-13-7-2-3-16-5-7/h7,13H,2-6H2,1H3.
What are the key properties of N-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide?
N-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 240.22 g/mol, XLogP of 0.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(oxolan-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 115689578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).