N-(2,4-dimethoxyphenyl)-4-phenylbenzamide

C21H19NO3 — CID 602380

IUPACN-(2,4-dimethoxyphenyl)-4-phenylbenzamide
SMILESCOc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)c(OC)c1
InChIInChI=1S/C21H19NO3/c1-24-18-12-13-19(20(14-18)25-2)22-21(23)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-14H,1-2H3,(H,22,23)
InChIKeyACFMPIGRXNBOQF-UHFFFAOYSA-N
MW333.39 g/mol
LogP4.62
Rot. Bonds5

About N-(2,4-dimethoxyphenyl)-4-phenylbenzamide

N-(2,4-dimethoxyphenyl)-4-phenylbenzamide (PubChem CID 602380) has the molecular formula C21H19NO3 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-4-phenylbenzamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-4-phenylbenzamide
PubChem CID602380
Molecular FormulaC21H19NO3
Molecular Weight333.39 g/mol
Exact Mass333.14
IUPAC NameN-(2,4-dimethoxyphenyl)-4-phenylbenzamide
SMILESCOc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)c(OC)c1
InChIInChI=1S/C21H19NO3/c1-24-18-12-13-19(20(14-18)25-2)22-21(23)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-14H,1-2H3,(H,22,23)
InChIKeyACFMPIGRXNBOQF-UHFFFAOYSA-N
XLogP4.62
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-dimethoxyphenyl)-4-phenylbenzamide
CID 667706
4-amino-N-(2,4-dimethoxyphenyl)benzamide
CID 8566750
N-(2,4-dimethoxyphenyl)-4-fluorobenzamide
CID 2832276
1-N-(2,4-dimethoxyphenyl)-4-N-propan-2-ylbenzene-1,4-dicarboxamide
CID 109043198
N-(2,4-dimethoxyphenyl)-4-[(6-phenylpyridazin-3-yl)amino]benzamide
CID 50777051
N-(2,4-dimethoxyphenyl)-4-pyrrol-1-ylbenzamide
CID 24536376
N-[(2,4-dimethoxyphenyl)carbamothioyl]benzamide
CID 2920046
1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide
CID 109043393
N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide
CID 1190439
N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-4-phenylbenzamide
CID 26522657
N-(2,4-dimethoxyphenyl)-3-hydroxybenzamide
CID 19256865
3-acetamido-N-(2,4-dimethoxyphenyl)-4-methoxybenzamide
CID 110764309

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-4-phenylbenzamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-4-phenylbenzamide (CID 602380) is N-(2,4-dimethoxyphenyl)-4-phenylbenzamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-4-phenylbenzamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-4-phenylbenzamide is COc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-4-phenylbenzamide?
The InChIKey is ACFMPIGRXNBOQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO3/c1-24-18-12-13-19(20(14-18)25-2)22-21(23)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-14H,1-2H3,(H,22,23).
What are the key properties of N-(2,4-dimethoxyphenyl)-4-phenylbenzamide?
N-(2,4-dimethoxyphenyl)-4-phenylbenzamide has a molecular weight of 333.39 g/mol, XLogP of 4.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-4-phenylbenzamide is sourced from PubChem (CID 602380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).