3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide

C22H28N2O5 — CID 26160383

IUPAC3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide
SMILESCCOCCOc1cccc(C(=O)Nc2cccc(C(=O)NCCCOC)c2)c1
InChIInChI=1S/C22H28N2O5/c1-3-28-13-14-29-20-10-5-8-18(16-20)22(26)24-19-9-4-7-17(15-19)21(25)23-11-6-12-27-2/h4-5,7-10,15-16H,3,6,11-14H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyBGFXTOCYVYOQND-UHFFFAOYSA-N
MW400.48 g/mol
LogP3.12
Rot. Bonds12

About 3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide

3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide (PubChem CID 26160383) has the molecular formula C22H28N2O5 and a molecular weight of 400.48 g/mol. Its IUPAC name is 3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide.

Molecular Properties

Compound Name3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide
PubChem CID26160383
Molecular FormulaC22H28N2O5
Molecular Weight400.48 g/mol
Exact Mass400.20
IUPAC Name3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide
SMILESCCOCCOc1cccc(C(=O)Nc2cccc(C(=O)NCCCOC)c2)c1
InChIInChI=1S/C22H28N2O5/c1-3-28-13-14-29-20-10-5-8-18(16-20)22(26)24-19-9-4-7-17(15-19)21(25)23-11-6-12-27-2/h4-5,7-10,15-16H,3,6,11-14H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyBGFXTOCYVYOQND-UHFFFAOYSA-N
XLogP3.12
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.48
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)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-(3-acetylphenyl)-3-(2-ethoxyethoxy)benzamide
CID 2238701
N-butyl-3-[[3-(2-ethoxyethoxy)benzoyl]carbamothioylamino]benzamide
CID 17197307
3-[[3-(2-ethoxyethoxy)benzoyl]carbamothioylamino]-N-(2-methoxyethyl)benzamide
CID 17219346
3-[(4-ethoxybenzoyl)amino]-N-(3-methoxypropyl)benzamide
CID 26160199
N-[4-(3-methoxypropylcarbamoyl)phenyl]-3-propoxybenzamide
CID 17205121
3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-propan-2-ylbenzamide
CID 17197543
3-[[2-[4-(2-ethoxyethoxy)anilino]-2-oxoethyl]amino]-N-(3-methoxypropyl)benzamide
CID 54842538
3-[(3-butoxybenzoyl)amino]-N-propylbenzamide
CID 17222720
3-(2-ethoxyethoxy)-N-hexadecylbenzamide
CID 17139521
3-[[2-[3-(2-ethoxyethoxy)anilino]acetyl]amino]-N-(2-methoxyethyl)benzamide
CID 54827524
N-butyl-3-[[2-[3-(2-ethoxyethoxy)anilino]-2-oxoethyl]amino]benzamide
CID 54834312
3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide
CID 17234430

Frequently Asked Questions

What is the IUPAC name of 3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide?
The IUPAC name of 3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide (CID 26160383) is 3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide.
What is the SMILES notation for 3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide?
The canonical SMILES for 3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide is CCOCCOc1cccc(C(=O)Nc2cccc(C(=O)NCCCOC)c2)c1.
What is the InChIKey of 3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide?
The InChIKey is BGFXTOCYVYOQND-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O5/c1-3-28-13-14-29-20-10-5-8-18(16-20)22(26)24-19-9-4-7-17(15-19)21(25)23-11-6-12-27-2/h4-5,7-10,15-16H,3,6,11-14H2,1-2H3,(H,23,25)(H,24,26).
What are the key properties of 3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide?
3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide has a molecular weight of 400.48 g/mol, XLogP of 3.12, 12 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-(3-methoxypropyl)benzamide is sourced from PubChem (CID 26160383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).