N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide

C24H24N2O3 — CID 7929215

IUPACN-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide
SMILESCCOc1ccc(NC(=O)c2ccc(NC(=O)c3cc(C)cc(C)c3)cc2)cc1
InChIInChI=1S/C24H24N2O3/c1-4-29-22-11-9-21(10-12-22)25-23(27)18-5-7-20(8-6-18)26-24(28)19-14-16(2)13-17(3)15-19/h5-15H,4H2,1-3H3,(H,25,27)(H,26,28)
InChIKeyPGKOOOXEHSZDOC-UHFFFAOYSA-N
MW388.47 g/mol
LogP5.21
Rot. Bonds6

About N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide

N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide (PubChem CID 7929215) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide.

Molecular Properties

Compound NameN-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide
PubChem CID7929215
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC NameN-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide
SMILESCCOc1ccc(NC(=O)c2ccc(NC(=O)c3cc(C)cc(C)c3)cc2)cc1
InChIInChI=1S/C24H24N2O3/c1-4-29-22-11-9-21(10-12-22)25-23(27)18-5-7-20(8-6-18)26-24(28)19-14-16(2)13-17(3)15-19/h5-15H,4H2,1-3H3,(H,25,27)(H,26,28)
InChIKeyPGKOOOXEHSZDOC-UHFFFAOYSA-N
XLogP5.21
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.47
LogP ≤ 55.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-(3,5-dimethylphenyl)-1-N-(4-ethoxyphenyl)benzene-1,3-dicarboxamide
CID 109057223
4-ethoxy-N-(4-hydroxyphenyl)benzamide
CID 13388921
4-N-(2,5-dimethylphenyl)-1-N-(4-ethoxyphenyl)benzene-1,4-dicarboxamide
CID 109049620
N-[4-[(4-bromobenzoyl)amino]phenyl]-4-ethoxybenzamide
CID 23876301
N-[4-(2-aminoethoxy)phenyl]-3,5-dimethylbenzamide
CID 43369278
3-N-(4-ethoxyphenyl)-1-N-(4-methylphenyl)benzene-1,3-dicarboxamide
CID 109056979
N-(4-ethoxyphenyl)-4-[(2-hydroxyacetyl)amino]benzamide
CID 8006880
N-(4-ethoxyphenyl)-3,5-difluorobenzamide
CID 8745463
N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 2115172
4-N-(4-ethoxyphenyl)-1-N-[(4-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046981
N-(4-ethoxyphenyl)-4-(2-phenoxyethoxy)benzamide
CID 4952680
4-ethoxy-N-(4-propan-2-ylphenyl)benzamide
CID 673574

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide?
The IUPAC name of N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide (CID 7929215) is N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide.
What is the SMILES notation for N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide?
The canonical SMILES for N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide is CCOc1ccc(NC(=O)c2ccc(NC(=O)c3cc(C)cc(C)c3)cc2)cc1.
What is the InChIKey of N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide?
The InChIKey is PGKOOOXEHSZDOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-4-29-22-11-9-21(10-12-22)25-23(27)18-5-7-20(8-6-18)26-24(28)19-14-16(2)13-17(3)15-19/h5-15H,4H2,1-3H3,(H,25,27)(H,26,28).
What are the key properties of N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide?
N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide has a molecular weight of 388.47 g/mol, XLogP of 5.21, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide is sourced from PubChem (CID 7929215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).