4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide

C24H24N2O2 — CID 55592158

IUPAC4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide
SMILESCCN(C(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1cc(C)ccc1C
InChIInChI=1S/C24H24N2O2/c1-4-26(22-16-17(2)10-11-18(22)3)24(28)20-12-14-21(15-13-20)25-23(27)19-8-6-5-7-9-19/h5-16H,4H2,1-3H3,(H,25,27)
InChIKeyUENWHRKWUBEXFP-UHFFFAOYSA-N
MW372.47 g/mol
LogP5.22
Rot. Bonds5

About 4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide

4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide (PubChem CID 55592158) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is 4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide.

Molecular Properties

Compound Name4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide
PubChem CID55592158
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC Name4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide
SMILESCCN(C(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1cc(C)ccc1C
InChIInChI=1S/C24H24N2O2/c1-4-26(22-16-17(2)10-11-18(22)3)24(28)20-12-14-21(15-13-20)25-23(27)19-8-6-5-7-9-19/h5-16H,4H2,1-3H3,(H,25,27)
InChIKeyUENWHRKWUBEXFP-UHFFFAOYSA-N
XLogP5.22
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.47
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide?
The IUPAC name of 4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide (CID 55592158) is 4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide.
What is the SMILES notation for 4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide?
The canonical SMILES for 4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide is CCN(C(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1cc(C)ccc1C.
What is the InChIKey of 4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide?
The InChIKey is UENWHRKWUBEXFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O2/c1-4-26(22-16-17(2)10-11-18(22)3)24(28)20-12-14-21(15-13-20)25-23(27)19-8-6-5-7-9-19/h5-16H,4H2,1-3H3,(H,25,27).
What are the key properties of 4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide?
4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide has a molecular weight of 372.47 g/mol, XLogP of 5.22, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzamido-N-(2,5-dimethylphenyl)-N-ethylbenzamide is sourced from PubChem (CID 55592158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).