N-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide

C14H20F3N3O — CID 78958162

IUPACN-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCN(C)CC(NC(=O)CNCC(F)(F)F)c1ccccc1
InChIInChI=1S/C14H20F3N3O/c1-20(2)9-12(11-6-4-3-5-7-11)19-13(21)8-18-10-14(15,16)17/h3-7,12,18H,8-10H2,1-2H3,(H,19,21)
InChIKeyAUVVABKXBIUHQD-UHFFFAOYSA-N
MW303.33 g/mol
LogP1.56
Rot. Bonds7

About N-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide

N-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 78958162) has the molecular formula C14H20F3N3O and a molecular weight of 303.33 g/mol. Its IUPAC name is N-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID78958162
Molecular FormulaC14H20F3N3O
Molecular Weight303.33 g/mol
Exact Mass303.16
IUPAC NameN-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCN(C)CC(NC(=O)CNCC(F)(F)F)c1ccccc1
InChIInChI=1S/C14H20F3N3O/c1-20(2)9-12(11-6-4-3-5-7-11)19-13(21)8-18-10-14(15,16)17/h3-7,12,18H,8-10H2,1-2H3,(H,19,21)
InChIKeyAUVVABKXBIUHQD-UHFFFAOYSA-N
XLogP1.56
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.33
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(dimethylamino)-1-phenylethyl]-3-propan-2-yloxypropanamide
CID 86929497
2-(4-aminophenyl)-N-[2-(dimethylamino)-1-phenylethyl]acetamide;dihydrochloride
CID 119836132
N-[(1R)-2-(dimethylamino)-1-phenylethyl]-3-(1,3-dioxoisoindol-2-yl)propanamide
CID 8936932
2-bromo-N-[2-(dimethylamino)-1-phenylethyl]propanamide
CID 107904840
1-[2-(dimethylamino)-1-phenylethyl]-3-(2-methyl-2-phenylpropyl)urea
CID 78880258
5-amino-N-[2-(dimethylamino)-1-phenylethyl]hexanamide
CID 82851272
N-[2-(dimethylamino)-1-phenylethyl]-2-(9-oxoacridin-10-yl)acetamide
CID 42883507
phenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate
CID 60676334
2-amino-N-[2-(dimethylamino)-1-phenylethyl]butanamide
CID 61248731
5-bromo-N-[2-[[(1S)-2-(dimethylamino)-1-phenylethyl]amino]-2-oxoethyl]furan-2-carboxamide
CID 8936906
N-[2-(dimethylamino)-1-phenylethyl]-3-(phenylcarbamoylamino)propanamide
CID 24504307
N-methyl-N-phenyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 78914951

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of N-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide (CID 78958162) is N-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for N-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide is CN(C)CC(NC(=O)CNCC(F)(F)F)c1ccccc1.
What is the InChIKey of N-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is AUVVABKXBIUHQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F3N3O/c1-20(2)9-12(11-6-4-3-5-7-11)19-13(21)8-18-10-14(15,16)17/h3-7,12,18H,8-10H2,1-2H3,(H,19,21).
What are the key properties of N-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide?
N-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 303.33 g/mol, XLogP of 1.56, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-1-phenylethyl]-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 78958162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).