N-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide

C26H28N2O4 — CID 17139628

IUPACN-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide
SMILESCCOCCOc1cccc(C(=O)Nc2ccccc2C(=O)N(C)Cc2ccccc2)c1
InChIInChI=1S/C26H28N2O4/c1-3-31-16-17-32-22-13-9-12-21(18-22)25(29)27-24-15-8-7-14-23(24)26(30)28(2)19-20-10-5-4-6-11-20/h4-15,18H,3,16-17,19H2,1-2H3,(H,27,29)
InChIKeyHCHPGTNXYMZLJG-UHFFFAOYSA-N
MW432.52 g/mol
LogP4.63
Rot. Bonds10

About N-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide

N-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide (PubChem CID 17139628) has the molecular formula C26H28N2O4 and a molecular weight of 432.52 g/mol. Its IUPAC name is N-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide.

Molecular Properties

Compound NameN-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide
PubChem CID17139628
Molecular FormulaC26H28N2O4
Molecular Weight432.52 g/mol
Exact Mass432.20
IUPAC NameN-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide
SMILESCCOCCOc1cccc(C(=O)Nc2ccccc2C(=O)N(C)Cc2ccccc2)c1
InChIInChI=1S/C26H28N2O4/c1-3-31-16-17-32-22-13-9-12-21(18-22)25(29)27-24-15-8-7-14-23(24)26(30)28(2)19-20-10-5-4-6-11-20/h4-15,18H,3,16-17,19H2,1-2H3,(H,27,29)
InChIKeyHCHPGTNXYMZLJG-UHFFFAOYSA-N
XLogP4.63
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.52
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide 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-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-phenylbenzamide
CID 17139549
N-benzyl-2-[(3-propoxybenzoyl)amino]benzamide
CID 4960084
N-(4-benzamidophenyl)-3-(2-ethoxyethoxy)benzamide
CID 17235482
N-benzyl-2-[(3-ethoxybenzoyl)amino]benzamide
CID 4957453
2-[[3-(2-ethoxyethoxy)benzoyl]carbamothioylamino]-N-ethyl-N-phenylbenzamide
CID 17186895
N-benzyl-3-[[2-[3-(2-ethoxyethoxy)anilino]acetyl]amino]-N-methylbenzamide
CID 54827428
2-benzamido-N-[(4-bromophenyl)methyl]-N-methylbenzamide
CID 32892148
N-benzyl-2-[(3-butan-2-yloxybenzoyl)carbamothioylamino]-N-methylbenzamide
CID 17150096
N-cyclohexyl-N-methyl-2-[[3-(2-phenoxyethoxy)benzoyl]amino]benzamide
CID 4955039
N-benzyl-2-[[4-(2-ethoxyethoxy)benzoyl]amino]benzamide
CID 17112651
N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide
CID 17231253
N-benzyl-N-methyl-3-(2-phenylethoxy)benzamide
CID 17134261

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide?
The IUPAC name of N-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide (CID 17139628) is N-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide.
What is the SMILES notation for N-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide?
The canonical SMILES for N-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide is CCOCCOc1cccc(C(=O)Nc2ccccc2C(=O)N(C)Cc2ccccc2)c1.
What is the InChIKey of N-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide?
The InChIKey is HCHPGTNXYMZLJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28N2O4/c1-3-31-16-17-32-22-13-9-12-21(18-22)25(29)27-24-15-8-7-14-23(24)26(30)28(2)19-20-10-5-4-6-11-20/h4-15,18H,3,16-17,19H2,1-2H3,(H,27,29).
What are the key properties of N-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide?
N-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide has a molecular weight of 432.52 g/mol, XLogP of 4.63, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-methylbenzamide is sourced from PubChem (CID 17139628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).