N-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide

C24H25N3O3 — CID 55880097

IUPACN-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide
SMILESCOc1ccc(C(=O)NCCNC(=O)c2ccccc2N(C)c2ccccc2)cc1
InChIInChI=1S/C24H25N3O3/c1-27(19-8-4-3-5-9-19)22-11-7-6-10-21(22)24(29)26-17-16-25-23(28)18-12-14-20(30-2)15-13-18/h3-15H,16-17H2,1-2H3,(H,25,28)(H,26,29)
InChIKeyGFPHMZIEIUJZIV-UHFFFAOYSA-N
MW403.48 g/mol
LogP3.62
Rot. Bonds8

About N-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide

N-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide (PubChem CID 55880097) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is N-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide.

Molecular Properties

Compound NameN-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide
PubChem CID55880097
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC NameN-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide
SMILESCOc1ccc(C(=O)NCCNC(=O)c2ccccc2N(C)c2ccccc2)cc1
InChIInChI=1S/C24H25N3O3/c1-27(19-8-4-3-5-9-19)22-11-7-6-10-21(22)24(29)26-17-16-25-23(28)18-12-14-20(30-2)15-13-18/h3-15H,16-17H2,1-2H3,(H,25,28)(H,26,29)
InChIKeyGFPHMZIEIUJZIV-UHFFFAOYSA-N
XLogP3.62
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 53.62
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-methoxy-2-(N-methylanilino)benzamide
CID 47216174
N-(2-acetamidoethyl)-4-methoxybenzamide
CID 30596623
N-[2-[(4-methoxybenzoyl)amino]ethyl]-4-methylbenzamide
CID 108537787
2-(2-cyanophenyl)-N-[2-[(4-methoxybenzoyl)amino]ethyl]benzamide
CID 55878950
4-methoxy-N-[4-oxo-4-(N-propan-2-ylanilino)butyl]benzamide
CID 55920471
N-[2-[(4-methoxyphenyl)carbamoylamino]ethyl]benzamide
CID 32527019
N-[2-[[(E)-3-(4-methoxyphenyl)but-2-enoyl]amino]ethyl]benzamide
CID 110309408
2-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide
CID 2193182
N-[2-(ethylamino)ethyl]-2-[(4-methoxybenzoyl)amino]benzamide
CID 119509230
ethyl 2-[acetyl-[2-[(4-methoxybenzoyl)amino]ethyl]amino]benzoate
CID 113064049
N-[2-[3,5-bis(trifluoromethyl)phenyl]ethyl]-2-(N-methylanilino)benzamide
CID 57046615
N-(2-benzamidoethyl)-4-(dimethylamino)benzamide
CID 38175898

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide?
The IUPAC name of N-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide (CID 55880097) is N-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide.
What is the SMILES notation for N-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide?
The canonical SMILES for N-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide is COc1ccc(C(=O)NCCNC(=O)c2ccccc2N(C)c2ccccc2)cc1.
What is the InChIKey of N-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide?
The InChIKey is GFPHMZIEIUJZIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c1-27(19-8-4-3-5-9-19)22-11-7-6-10-21(22)24(29)26-17-16-25-23(28)18-12-14-20(30-2)15-13-18/h3-15H,16-17H2,1-2H3,(H,25,28)(H,26,29).
What are the key properties of N-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide?
N-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide has a molecular weight of 403.48 g/mol, XLogP of 3.62, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-methoxybenzoyl)amino]ethyl]-2-(N-methylanilino)benzamide is sourced from PubChem (CID 55880097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).