2-[4-(diethylamino)anilino]-N-phenylacetamide

C18H23N3O — CID 70365941

IUPAC2-[4-(diethylamino)anilino]-N-phenylacetamide
SMILESCCN(CC)c1ccc(NCC(=O)Nc2ccccc2)cc1
InChIInChI=1S/C18H23N3O/c1-3-21(4-2)17-12-10-15(11-13-17)19-14-18(22)20-16-8-6-5-7-9-16/h5-13,19H,3-4,14H2,1-2H3,(H,20,22)
InChIKeyAOVSPZHTXXBVQB-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.58
Rot. Bonds7

About 2-[4-(diethylamino)anilino]-N-phenylacetamide

2-[4-(diethylamino)anilino]-N-phenylacetamide (PubChem CID 70365941) has the molecular formula C18H23N3O and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-[4-(diethylamino)anilino]-N-phenylacetamide.

Molecular Properties

Compound Name2-[4-(diethylamino)anilino]-N-phenylacetamide
PubChem CID70365941
Molecular FormulaC18H23N3O
Molecular Weight297.40 g/mol
Exact Mass297.18
IUPAC Name2-[4-(diethylamino)anilino]-N-phenylacetamide
SMILESCCN(CC)c1ccc(NCC(=O)Nc2ccccc2)cc1
InChIInChI=1S/C18H23N3O/c1-3-21(4-2)17-12-10-15(11-13-17)19-14-18(22)20-16-8-6-5-7-9-16/h5-13,19H,3-4,14H2,1-2H3,(H,20,22)
InChIKeyAOVSPZHTXXBVQB-UHFFFAOYSA-N
XLogP3.58
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[4-(diethylamino)anilino]-N-phenylacetamide 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

2-[4-(diethylamino)anilino]-N-[4-(diethylamino)phenyl]acetamide
CID 109010373
2-[4-(diethylamino)anilino]-N-(2-methylphenyl)acetamide
CID 109007146
N-[4-(diethylamino)phenyl]-2-(3,4-dimethylanilino)acetamide
CID 109007429
2-[4-(diethylamino)anilino]acetic acid;dihydrochloride
CID 131880910
2-[4-(diethylamino)anilino]-N-(2-phenylethyl)acetamide
CID 109000006
N-[4-(diethylamino)phenyl]-2-(2-phenoxyanilino)acetamide
CID 109010429
N-[4-(diethylamino)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide
CID 109009742
2-[4-(diethylamino)anilino]-N-(2-ethyl-6-methylphenyl)acetamide
CID 109007808
N-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide
CID 60641172
3-[4-(diethylamino)anilino]-3-oxopropanoic acid
CID 62230045
N-(2,3-dichlorophenyl)-2-[4-(diethylamino)anilino]acetamide
CID 109010402
N-phenyl-2-(4-propylanilino)acetamide
CID 43215416

Frequently Asked Questions

What is the IUPAC name of 2-[4-(diethylamino)anilino]-N-phenylacetamide?
The IUPAC name of 2-[4-(diethylamino)anilino]-N-phenylacetamide (CID 70365941) is 2-[4-(diethylamino)anilino]-N-phenylacetamide.
What is the SMILES notation for 2-[4-(diethylamino)anilino]-N-phenylacetamide?
The canonical SMILES for 2-[4-(diethylamino)anilino]-N-phenylacetamide is CCN(CC)c1ccc(NCC(=O)Nc2ccccc2)cc1.
What is the InChIKey of 2-[4-(diethylamino)anilino]-N-phenylacetamide?
The InChIKey is AOVSPZHTXXBVQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O/c1-3-21(4-2)17-12-10-15(11-13-17)19-14-18(22)20-16-8-6-5-7-9-16/h5-13,19H,3-4,14H2,1-2H3,(H,20,22).
What are the key properties of 2-[4-(diethylamino)anilino]-N-phenylacetamide?
2-[4-(diethylamino)anilino]-N-phenylacetamide has a molecular weight of 297.40 g/mol, XLogP of 3.58, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(diethylamino)anilino]-N-phenylacetamide is sourced from PubChem (CID 70365941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).