N-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide

C20H25N3O2 — CID 41278360

IUPACN-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide
SMILESCCN(CCCNC(=O)CNC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H25N3O2/c1-2-23(18-12-7-4-8-13-18)15-9-14-21-19(24)16-22-20(25)17-10-5-3-6-11-17/h3-8,10-13H,2,9,14-16H2,1H3,(H,21,24)(H,22,25)
InChIKeyKZOMUIDHOAMOGX-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.45
Rot. Bonds9

About N-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide

N-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide (PubChem CID 41278360) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is N-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide
PubChem CID41278360
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC NameN-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide
SMILESCCN(CCCNC(=O)CNC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H25N3O2/c1-2-23(18-12-7-4-8-13-18)15-9-14-21-19(24)16-22-20(25)17-10-5-3-6-11-17/h3-8,10-13H,2,9,14-16H2,1H3,(H,21,24)(H,22,25)
InChIKeyKZOMUIDHOAMOGX-UHFFFAOYSA-N
XLogP2.45
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide 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-[[2-[4-[[2-[(2-benzamidoacetyl)amino]acetyl]amino]butylamino]-2-oxoethyl]amino]-2-oxoethyl]benzamide
CID 101335616
3-(N-ethylanilino)propylurea
CID 112708177
3-(ethylamino)-N-[3-(N-ethylanilino)propyl]propanamide
CID 62834234
methyl N-[3-(N-ethylanilino)propyl]carbamate
CID 22765561
N-[4-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]-1,3-thiazol-2-yl]benzamide
CID 18137460
N-[3-(dimethylamino)propyl]-2-(N-ethylanilino)acetamide
CID 108995270
3-(diethylsulfamoyl)-N-[3-(N-ethylanilino)propyl]benzamide
CID 27897925
N-[2-[3-(methylamino)propylamino]-2-oxoethyl]benzamide;hydrochloride
CID 119432544
N-[3-(N-ethylanilino)propyl]-2-(2-nitrophenyl)acetamide
CID 41278296
N-[3-(N-ethylanilino)propyl]-1H-indazole-3-carboxamide
CID 41277786
2-(2-aminoethoxy)-N-[3-(N-ethylanilino)propyl]acetamide
CID 79473705
N-[3-(N-ethylanilino)propyl]-2-(3-methoxyphenyl)acetamide
CID 18118732

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide?
The IUPAC name of N-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide (CID 41278360) is N-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide is CCN(CCCNC(=O)CNC(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of N-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide?
The InChIKey is KZOMUIDHOAMOGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-2-23(18-12-7-4-8-13-18)15-9-14-21-19(24)16-22-20(25)17-10-5-3-6-11-17/h3-8,10-13H,2,9,14-16H2,1H3,(H,21,24)(H,22,25).
What are the key properties of N-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide?
N-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide has a molecular weight of 339.44 g/mol, XLogP of 2.45, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-(N-ethylanilino)propylamino]-2-oxoethyl]benzamide is sourced from PubChem (CID 41278360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).