3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide

C21H19NO2 — CID 890400

IUPAC3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide
SMILESCOc1ccc(-c2cccc(C(=O)Nc3ccccc3C)c2)cc1
InChIInChI=1S/C21H19NO2/c1-15-6-3-4-9-20(15)22-21(23)18-8-5-7-17(14-18)16-10-12-19(24-2)13-11-16/h3-14H,1-2H3,(H,22,23)
InChIKeySHZTXOSVECDWHU-UHFFFAOYSA-N
MW317.39 g/mol
LogP4.92
Rot. Bonds4

About 3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide

3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide (PubChem CID 890400) has the molecular formula C21H19NO2 and a molecular weight of 317.39 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide
PubChem CID890400
Molecular FormulaC21H19NO2
Molecular Weight317.39 g/mol
Exact Mass317.14
IUPAC Name3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide
SMILESCOc1ccc(-c2cccc(C(=O)Nc3ccccc3C)c2)cc1
InChIInChI=1S/C21H19NO2/c1-15-6-3-4-9-20(15)22-21(23)18-8-5-7-17(14-18)16-10-12-19(24-2)13-11-16/h3-14H,1-2H3,(H,22,23)
InChIKeySHZTXOSVECDWHU-UHFFFAOYSA-N
XLogP4.92
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Encainide
CID 48041
Encainide Hydrochloride
CID 48040
Benzenepropanamide, N-(2-methoxyphenyl)-beta-oxo-
CID 7079
4-Methoxy-N-(4-methoxyphenyl)benzamide
CID 346815
N-(4-methoxyphenyl)-4-methylbenzamide
CID 531829
VU0357121
CID 2296132
6-Methoxy-2-phenyl-4-quinolone
CID 124348
4-Methoxy-N-(1-naphthyl)benzamide
CID 303390
N-(4-methoxyphenyl)-2-(1-naphthyl)acetamide
CID 835395
2-Naphthalenecarboxamide, N-(2-ethoxyphenyl)-
CID 78442
N-(4-Methoxyphenyl)benzoic acid amide
CID 139031
4-Methoxy-N-(3-methylphenyl)benzamide
CID 346046

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide?
The IUPAC name of 3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide (CID 890400) is 3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide.
What is the SMILES notation for 3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide?
The canonical SMILES for 3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide is COc1ccc(-c2cccc(C(=O)Nc3ccccc3C)c2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide?
The InChIKey is SHZTXOSVECDWHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO2/c1-15-6-3-4-9-20(15)22-21(23)18-8-5-7-17(14-18)16-10-12-19(24-2)13-11-16/h3-14H,1-2H3,(H,22,23).
What are the key properties of 3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide?
3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide has a molecular weight of 317.39 g/mol, XLogP of 4.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-N-(2-methylphenyl)benzamide is sourced from PubChem (CID 890400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).