N-(2-methoxyethyl)-N',N'-diphenylbutanediamide

C19H22N2O3 — CID 3996534

IUPACN-(2-methoxyethyl)-N',N'-diphenylbutanediamide
SMILESCOCCNC(=O)CCC(=O)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-24-15-14-20-18(22)12-13-19(23)21(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11H,12-15H2,1H3,(H,20,22)
InChIKeyUCUAUNOOGZFDFS-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.89
Rot. Bonds8

About N-(2-methoxyethyl)-N',N'-diphenylbutanediamide

N-(2-methoxyethyl)-N',N'-diphenylbutanediamide (PubChem CID 3996534) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N',N'-diphenylbutanediamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N',N'-diphenylbutanediamide
PubChem CID3996534
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-(2-methoxyethyl)-N',N'-diphenylbutanediamide
SMILESCOCCNC(=O)CCC(=O)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-24-15-14-20-18(22)12-13-19(23)21(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11H,12-15H2,1H3,(H,20,22)
InChIKeyUCUAUNOOGZFDFS-UHFFFAOYSA-N
XLogP2.89
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2-methoxyethyl)-N',N'-diphenylbutanediamide 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-[6-(2-methoxyethylamino)-6-oxohexyl]benzamide
CID 110839208
4-oxo-N,N-diphenyl-4-(2-propanoylhydrazinyl)butanamide
CID 5165535
4-(2-acetylhydrazinyl)-4-oxo-N,N-diphenylbutanamide
CID 51362140
N'-(4-aminophenyl)-N-(2-methoxyethyl)-N'-phenyloxamide
CID 108504994
N-(2-methoxyethyl)-2-[3-(N-methylanilino)propylamino]acetamide
CID 60693730
N,N'-bis(2-methoxyethyl)hexanediamide
CID 2933923
3-[N-(2-methoxyethylcarbamoyl)anilino]propanoic acid
CID 61187915
2-(N-(3-amino-3-sulfanylidenepropyl)anilino)-N-(2-methoxyethyl)acetamide
CID 61487413
N-(2-methoxyethyl)-3,3-diphenylpropanamide
CID 2263132
N-(2-methoxyethyl)-2-(4-phenylphenyl)acetamide
CID 2094675
methyl (2R)-4-methyl-2-[[4-oxo-4-(N-phenylanilino)butanoyl]amino]pentanoate
CID 7315878
3-[(2-chloro-2-phenylacetyl)amino]-N-(2-methoxyethyl)propanamide
CID 115649428

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N',N'-diphenylbutanediamide?
The IUPAC name of N-(2-methoxyethyl)-N',N'-diphenylbutanediamide (CID 3996534) is N-(2-methoxyethyl)-N',N'-diphenylbutanediamide.
What is the SMILES notation for N-(2-methoxyethyl)-N',N'-diphenylbutanediamide?
The canonical SMILES for N-(2-methoxyethyl)-N',N'-diphenylbutanediamide is COCCNC(=O)CCC(=O)N(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2-methoxyethyl)-N',N'-diphenylbutanediamide?
The InChIKey is UCUAUNOOGZFDFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-24-15-14-20-18(22)12-13-19(23)21(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11H,12-15H2,1H3,(H,20,22).
What are the key properties of N-(2-methoxyethyl)-N',N'-diphenylbutanediamide?
N-(2-methoxyethyl)-N',N'-diphenylbutanediamide has a molecular weight of 326.40 g/mol, XLogP of 2.89, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N',N'-diphenylbutanediamide is sourced from PubChem (CID 3996534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).