N-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide

C25H26N2O4 — CID 17355422

IUPACN-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide
SMILESCOCCOc1ccccc1C(=O)Nc1ccccc1C(=O)Nc1ccc(C)c(C)c1
InChIInChI=1S/C25H26N2O4/c1-17-12-13-19(16-18(17)2)26-24(28)20-8-4-6-10-22(20)27-25(29)21-9-5-7-11-23(21)31-15-14-30-3/h4-13,16H,14-15H2,1-3H3,(H,26,28)(H,27,29)
InChIKeyYQAWEUCBTGREDT-UHFFFAOYSA-N
MW418.49 g/mol
LogP4.83
Rot. Bonds8

About N-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide

N-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide (PubChem CID 17355422) has the molecular formula C25H26N2O4 and a molecular weight of 418.49 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide
PubChem CID17355422
Molecular FormulaC25H26N2O4
Molecular Weight418.49 g/mol
Exact Mass418.19
IUPAC NameN-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide
SMILESCOCCOc1ccccc1C(=O)Nc1ccccc1C(=O)Nc1ccc(C)c(C)c1
InChIInChI=1S/C25H26N2O4/c1-17-12-13-19(16-18(17)2)26-24(28)20-8-4-6-10-22(20)27-25(29)21-9-5-7-11-23(21)31-15-14-30-3/h4-13,16H,14-15H2,1-3H3,(H,26,28)(H,27,29)
InChIKeyYQAWEUCBTGREDT-UHFFFAOYSA-N
XLogP4.83
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.49
LogP ≤ 54.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3,4-dimethylphenyl)-2-[(2-propoxybenzoyl)amino]benzamide
CID 4948024
N-(3,4-dimethylphenyl)-2-[[2-(3-methylbutoxy)benzoyl]amino]benzamide
CID 4943608
N-(3-chloro-4-methylphenyl)-2-(2-methoxyethoxy)benzamide
CID 17355384
N-(3,4-dimethylphenyl)-2-pentoxybenzamide
CID 4946489
methyl 3-[2-[(3,4-dimethylphenyl)carbamoyl]anilino]-3-oxopropanoate
CID 28637999
1-N,4-N-bis[2-[(3,4-dimethylphenyl)carbamoyl]phenyl]benzene-1,4-dicarboxamide
CID 4945134
2-(2-methoxyethoxy)-N-(4-methyl-3-nitrophenyl)benzamide
CID 60567354
N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide
CID 17355423
5-bromo-N-[2-[(3,4-dimethylphenyl)carbamoyl]phenyl]-2-methoxybenzamide
CID 17094295
3-bromo-4-butoxy-N-[2-[(3,4-dimethylphenyl)carbamoyl]phenyl]benzamide
CID 4955844
5-bromo-N-[2-[(3,4-dimethylphenyl)carbamoyl]phenyl]-2-(2-methylpropoxy)benzamide
CID 17050838
N,N'-bis[2-[(3,4-dimethylphenyl)carbamoyl]phenyl]hexanediamide
CID 4945136

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide?
The IUPAC name of N-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide (CID 17355422) is N-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide is COCCOc1ccccc1C(=O)Nc1ccccc1C(=O)Nc1ccc(C)c(C)c1.
What is the InChIKey of N-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide?
The InChIKey is YQAWEUCBTGREDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O4/c1-17-12-13-19(16-18(17)2)26-24(28)20-8-4-6-10-22(20)27-25(29)21-9-5-7-11-23(21)31-15-14-30-3/h4-13,16H,14-15H2,1-3H3,(H,26,28)(H,27,29).
What are the key properties of N-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide?
N-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide has a molecular weight of 418.49 g/mol, XLogP of 4.83, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide is sourced from PubChem (CID 17355422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).