3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide

C24H24N2O3 — CID 17221972

IUPAC3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide
SMILESCCOc1ccc(C(=O)Nc2cccc(C(=O)N(CC)c3ccccc3)c2)cc1
InChIInChI=1S/C24H24N2O3/c1-3-26(21-11-6-5-7-12-21)24(28)19-9-8-10-20(17-19)25-23(27)18-13-15-22(16-14-18)29-4-2/h5-17H,3-4H2,1-2H3,(H,25,27)
InChIKeyKDONMWRGJSIISN-UHFFFAOYSA-N
MW388.47 g/mol
LogP5.00
Rot. Bonds7

About 3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide

3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide (PubChem CID 17221972) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is 3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide.

Molecular Properties

Compound Name3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide
PubChem CID17221972
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide
SMILESCCOc1ccc(C(=O)Nc2cccc(C(=O)N(CC)c3ccccc3)c2)cc1
InChIInChI=1S/C24H24N2O3/c1-3-26(21-11-6-5-7-12-21)24(28)19-9-8-10-20(17-19)25-23(27)18-13-15-22(16-14-18)29-4-2/h5-17H,3-4H2,1-2H3,(H,25,27)
InChIKeyKDONMWRGJSIISN-UHFFFAOYSA-N
XLogP5.00
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.47
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3-[[3-(2-phenoxyethoxy)benzoyl]amino]-N-phenylbenzamide
CID 17222007
N-[3-[ethyl(phenyl)carbamoyl]phenyl]pyridine-4-carboxamide
CID 17221980
4-ethoxy-N-ethyl-N-phenylbenzamide
CID 721190
3-acetamido-N-ethyl-N-phenylbenzamide
CID 17221925
4-N-ethyl-1-N,4-N-diphenylbenzene-1,4-dicarboxamide
CID 109049216
5-bromo-2-ethoxy-N-[3-[ethyl(phenyl)carbamoyl]phenyl]benzamide
CID 17222029
1-N-(3-cyanophenyl)-4-N-ethyl-4-N-phenylbenzene-1,4-dicarboxamide
CID 109049797
3-[(4-ethoxybenzoyl)amino]-N-methylbenzamide
CID 17233089
ethyl 3-[(4-ethoxybenzoyl)amino]benzoate
CID 836694
3-[(4-ethoxybenzoyl)amino]-N-(4-methoxyphenyl)benzamide
CID 1228510
N-ethyl-3-[[2-[4-(2-methylpropoxy)anilino]acetyl]amino]-N-phenylbenzamide
CID 54820208
3-bromo-4-ethoxy-N-[[3-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide
CID 17222187

Frequently Asked Questions

What is the IUPAC name of 3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide?
The IUPAC name of 3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide (CID 17221972) is 3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide.
What is the SMILES notation for 3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide?
The canonical SMILES for 3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide is CCOc1ccc(C(=O)Nc2cccc(C(=O)N(CC)c3ccccc3)c2)cc1.
What is the InChIKey of 3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide?
The InChIKey is KDONMWRGJSIISN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-3-26(21-11-6-5-7-12-21)24(28)19-9-8-10-20(17-19)25-23(27)18-13-15-22(16-14-18)29-4-2/h5-17H,3-4H2,1-2H3,(H,25,27).
What are the key properties of 3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide?
3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide has a molecular weight of 388.47 g/mol, XLogP of 5.00, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-ethoxybenzoyl)amino]-N-ethyl-N-phenylbenzamide is sourced from PubChem (CID 17221972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).