N-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide

C22H19NO3 — CID 52843930

IUPACN-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide
SMILESCOc1cc(C(=O)Nc2cccc(C(=O)c3ccccc3)c2)ccc1C
InChIInChI=1S/C22H19NO3/c1-15-11-12-18(14-20(15)26-2)22(25)23-19-10-6-9-17(13-19)21(24)16-7-4-3-5-8-16/h3-14H,1-2H3,(H,23,25)
InChIKeyNFGNIWCNYSKVDA-UHFFFAOYSA-N
MW345.40 g/mol
LogP4.49
Rot. Bonds5

About N-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide

N-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide (PubChem CID 52843930) has the molecular formula C22H19NO3 and a molecular weight of 345.40 g/mol. Its IUPAC name is N-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide.

Molecular Properties

Compound NameN-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide
PubChem CID52843930
Molecular FormulaC22H19NO3
Molecular Weight345.40 g/mol
Exact Mass345.14
IUPAC NameN-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide
SMILESCOc1cc(C(=O)Nc2cccc(C(=O)c3ccccc3)c2)ccc1C
InChIInChI=1S/C22H19NO3/c1-15-11-12-18(14-20(15)26-2)22(25)23-19-10-6-9-17(13-19)21(24)16-7-4-3-5-8-16/h3-14H,1-2H3,(H,23,25)
InChIKeyNFGNIWCNYSKVDA-UHFFFAOYSA-N
XLogP4.49
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-4-methyl-N-[3-(morpholine-4-carbonyl)phenyl]benzamide
CID 55748732
3-methoxy-4-methyl-N-[3-(trifluoromethoxy)phenyl]benzamide
CID 38033064
3-methoxy-4-methyl-N-(4-methylphenyl)benzamide
CID 9071746
N-[(1R)-1-(3-benzamidophenyl)ethyl]-3-methoxy-N,4-dimethylbenzamide
CID 31870263
N-(3,5-dimethoxyphenyl)-3-methoxy-4-methylbenzamide
CID 16619720
3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide
CID 5082074
2,6-dimethoxy-N-[2-methyl-5-(phenylcarbamoyl)phenyl]benzamide
CID 154838760
3-[(4-ethoxy-3-methoxybenzoyl)amino]benzoic acid
CID 45426053
N-(4-benzoylphenyl)-3-methoxy-4-phenylmethoxybenzamide
CID 139779423
methyl 3-[(4-methoxy-3-phenylbenzoyl)amino]benzoate
CID 110424178
3-[[3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzoyl]amino]benzoic acid
CID 1081903
N-[4-(hydroxymethyl)phenyl]-3-methoxy-4-methylbenzamide
CID 64793166

Frequently Asked Questions

What is the IUPAC name of N-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide?
The IUPAC name of N-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide (CID 52843930) is N-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide.
What is the SMILES notation for N-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide?
The canonical SMILES for N-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide is COc1cc(C(=O)Nc2cccc(C(=O)c3ccccc3)c2)ccc1C.
What is the InChIKey of N-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide?
The InChIKey is NFGNIWCNYSKVDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19NO3/c1-15-11-12-18(14-20(15)26-2)22(25)23-19-10-6-9-17(13-19)21(24)16-7-4-3-5-8-16/h3-14H,1-2H3,(H,23,25).
What are the key properties of N-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide?
N-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide has a molecular weight of 345.40 g/mol, XLogP of 4.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzoylphenyl)-3-methoxy-4-methylbenzamide is sourced from PubChem (CID 52843930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).