N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide

C19H22F3N3O — CID 109009742

IUPACN-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide
SMILESCCN(CC)c1ccc(NC(=O)CNc2cccc(C(F)(F)F)c2)cc1
InChIInChI=1S/C19H22F3N3O/c1-3-25(4-2)17-10-8-15(9-11-17)24-18(26)13-23-16-7-5-6-14(12-16)19(20,21)22/h5-12,23H,3-4,13H2,1-2H3,(H,24,26)
InChIKeyGIQYDMQUBZHYGW-UHFFFAOYSA-N
MW365.40 g/mol
LogP4.60
Rot. Bonds7

About N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide

N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide (PubChem CID 109009742) has the molecular formula C19H22F3N3O and a molecular weight of 365.40 g/mol. Its IUPAC name is N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide.

Molecular Properties

Compound NameN-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide
PubChem CID109009742
Molecular FormulaC19H22F3N3O
Molecular Weight365.40 g/mol
Exact Mass365.17
IUPAC NameN-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide
SMILESCCN(CC)c1ccc(NC(=O)CNc2cccc(C(F)(F)F)c2)cc1
InChIInChI=1S/C19H22F3N3O/c1-3-25(4-2)17-10-8-15(9-11-17)24-18(26)13-23-16-7-5-6-14(12-16)19(20,21)22/h5-12,23H,3-4,13H2,1-2H3,(H,24,26)
InChIKeyGIQYDMQUBZHYGW-UHFFFAOYSA-N
XLogP4.60
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.40
LogP ≤ 54.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]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-[[4-(diethylamino)phenyl]methylideneamino]-2-[3-(trifluoromethyl)anilino]acetamide
CID 2353577
N-(3-methylphenyl)-2-[3-(trifluoromethyl)anilino]acetamide
CID 7409922
2-[4-(diethylamino)anilino]-N-phenylacetamide
CID 70365941
N,N-diethyl-4-[[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]amino]benzamide
CID 54834141
2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide
CID 109010373
N-(3,4-difluorophenyl)-2-[3-(trifluoromethyl)anilino]acetamide
CID 7409925
N-[4-(2,2,2-trifluoroethoxy)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide
CID 56550067
N-ethyl-4-[[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]amino]-N-phenylbenzamide
CID 54838383
N-[4-(diethylamino)phenyl]-2-(3,4-dimethylanilino)acetamide
CID 109007429
N-(3,4-dichlorophenyl)-2-[3-(trifluoromethyl)anilino]acetamide
CID 7922707
N-(4-hexoxyphenyl)-2-[3-(trifluoromethyl)anilino]acetamide
CID 54833824
3-[[2-[3-[ethyl(phenyl)carbamoyl]anilino]acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 54839033

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide?
The IUPAC name of N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide (CID 109009742) is N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide.
What is the SMILES notation for N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide?
The canonical SMILES for N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide is CCN(CC)c1ccc(NC(=O)CNc2cccc(C(F)(F)F)c2)cc1.
What is the InChIKey of N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide?
The InChIKey is GIQYDMQUBZHYGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22F3N3O/c1-3-25(4-2)17-10-8-15(9-11-17)24-18(26)13-23-16-7-5-6-14(12-16)19(20,21)22/h5-12,23H,3-4,13H2,1-2H3,(H,24,26).
What are the key properties of N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide?
N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide has a molecular weight of 365.40 g/mol, XLogP of 4.60, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide is sourced from PubChem (CID 109009742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).