N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide

C16H25N3O3 — CID 54833942

IUPACN,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide
SMILESCCN(CC)C(=O)c1ccc(NCC(=O)NCCOC)cc1
InChIInChI=1S/C16H25N3O3/c1-4-19(5-2)16(21)13-6-8-14(9-7-13)18-12-15(20)17-10-11-22-3/h6-9,18H,4-5,10-12H2,1-3H3,(H,17,20)
InChIKeyXGFXRSXTAJGXQH-UHFFFAOYSA-N
MW307.39 g/mol
LogP1.34
Rot. Bonds9

About N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide

N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide (PubChem CID 54833942) has the molecular formula C16H25N3O3 and a molecular weight of 307.39 g/mol. Its IUPAC name is N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide.

Molecular Properties

Compound NameN,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide
PubChem CID54833942
Molecular FormulaC16H25N3O3
Molecular Weight307.39 g/mol
Exact Mass307.19
IUPAC NameN,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide
SMILESCCN(CC)C(=O)c1ccc(NCC(=O)NCCOC)cc1
InChIInChI=1S/C16H25N3O3/c1-4-19(5-2)16(21)13-6-8-14(9-7-13)18-12-15(20)17-10-11-22-3/h6-9,18H,4-5,10-12H2,1-3H3,(H,17,20)
InChIKeyXGFXRSXTAJGXQH-UHFFFAOYSA-N
XLogP1.34
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]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

4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N,N-dipropylbenzamide
CID 54831987
N,N-diethyl-4-[[2-oxo-2-(propylamino)ethyl]amino]benzamide
CID 54833878
3-[[2-[4-(diethylcarbamoyl)anilino]acetyl]amino]-N-(2-methoxyethyl)benzamide
CID 54833883
4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-propylbenzamide
CID 54835797
N,N-diethyl-3-[[2-[4-(2-methoxyethylcarbamoyl)anilino]acetyl]amino]benzamide
CID 54836242
2-(4-chloroanilino)-N-(2-methoxyethyl)acetamide
CID 39347241
4-[[2-[4-(diethylcarbamoyl)anilino]-2-oxoethyl]amino]-N-methylbenzamide
CID 54846187
N-benzyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide
CID 54844190
N,N-diethyl-4-[[2-oxo-2-(4-propoxyanilino)ethyl]amino]benzamide
CID 54834104
2-[4-(azepane-1-carbonyl)anilino]-N-(2-methoxyethyl)acetamide
CID 54835172
N-(2-methoxyethyl)-2-[4-(piperidine-1-carbonyl)anilino]acetamide
CID 54841382
4-[[2-(4-bromoanilino)-2-oxoethyl]amino]-N,N-diethylbenzamide
CID 54834198

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide?
The IUPAC name of N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide (CID 54833942) is N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide.
What is the SMILES notation for N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide?
The canonical SMILES for N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide is CCN(CC)C(=O)c1ccc(NCC(=O)NCCOC)cc1.
What is the InChIKey of N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide?
The InChIKey is XGFXRSXTAJGXQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O3/c1-4-19(5-2)16(21)13-6-8-14(9-7-13)18-12-15(20)17-10-11-22-3/h6-9,18H,4-5,10-12H2,1-3H3,(H,17,20).
What are the key properties of N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide?
N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide has a molecular weight of 307.39 g/mol, XLogP of 1.34, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide is sourced from PubChem (CID 54833942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).