2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide

C24H25N3O3 — CID 30568013

IUPAC2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide
SMILESCCOc1ccccc1NCC(=O)Nc1ccccc1C(=O)Nc1cccc(C)c1
InChIInChI=1S/C24H25N3O3/c1-3-30-22-14-7-6-13-21(22)25-16-23(28)27-20-12-5-4-11-19(20)24(29)26-18-10-8-9-17(2)15-18/h4-15,25H,3,16H2,1-2H3,(H,26,29)(H,27,28)
InChIKeyKWJOFVMULAXNST-UHFFFAOYSA-N
MW403.48 g/mol
LogP4.70
Rot. Bonds8

About 2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide

2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide (PubChem CID 30568013) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is 2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide.

Molecular Properties

Compound Name2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide
PubChem CID30568013
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC Name2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide
SMILESCCOc1ccccc1NCC(=O)Nc1ccccc1C(=O)Nc1cccc(C)c1
InChIInChI=1S/C24H25N3O3/c1-3-30-22-14-7-6-13-21(22)25-16-23(28)27-20-12-5-4-11-19(20)24(29)26-18-10-8-9-17(2)15-18/h4-15,25H,3,16H2,1-2H3,(H,26,29)(H,27,28)
InChIKeyKWJOFVMULAXNST-UHFFFAOYSA-N
XLogP4.70
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 54.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-ethoxyanilino)-N-(3-ethoxyphenyl)acetamide
CID 54817200
2-ethoxy-N-[3-[(3-methylphenyl)carbamoyl]phenyl]benzamide
CID 1228354
ethyl 2-[2-[2-[(3-methylphenyl)carbamoyl]anilino]-2-oxoethyl]sulfanylacetate
CID 8594868
N-(3-methylphenyl)-2-(propylamino)benzamide
CID 62171242
N-[3-[[2-(2-ethoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide
CID 54817227
N-[3-[2-(2-ethoxyanilino)-2-oxoethyl]sulfanylphenyl]-2-methylbenzamide
CID 18906524
N-(3-cyanophenyl)-2-(2-ethoxyanilino)acetamide
CID 9102058
N-[3-[[2-(2-ethoxyanilino)acetyl]amino]phenyl]hexanamide
CID 54817487
ethyl 2-[[2-(2-ethoxyanilino)-2-oxoethyl]amino]benzoate
CID 109009177
2-[[2-(3-methylanilino)acetyl]amino]benzoic acid
CID 10589114
3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide
CID 29458921
4-(2-ethoxyanilino)-N-(3-methylphenyl)pyridine-2-carboxamide
CID 109219092

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide?
The IUPAC name of 2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide (CID 30568013) is 2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide.
What is the SMILES notation for 2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide?
The canonical SMILES for 2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide is CCOc1ccccc1NCC(=O)Nc1ccccc1C(=O)Nc1cccc(C)c1.
What is the InChIKey of 2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide?
The InChIKey is KWJOFVMULAXNST-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c1-3-30-22-14-7-6-13-21(22)25-16-23(28)27-20-12-5-4-11-19(20)24(29)26-18-10-8-9-17(2)15-18/h4-15,25H,3,16H2,1-2H3,(H,26,29)(H,27,28).
What are the key properties of 2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide?
2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide has a molecular weight of 403.48 g/mol, XLogP of 4.70, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide is sourced from PubChem (CID 30568013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).