3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide

C23H23NO2 — CID 18208620

IUPAC3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide
SMILESCOc1cc(C(=O)NC(c2ccccc2)c2ccc(C)cc2)ccc1C
InChIInChI=1S/C23H23NO2/c1-16-9-12-19(13-10-16)22(18-7-5-4-6-8-18)24-23(25)20-14-11-17(2)21(15-20)26-3/h4-15,22H,1-3H3,(H,24,25)
InChIKeyZYBDEESXLPZAIB-UHFFFAOYSA-N
MW345.44 g/mol
LogP4.83
Rot. Bonds5

About 3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide

3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide (PubChem CID 18208620) has the molecular formula C23H23NO2 and a molecular weight of 345.44 g/mol. Its IUPAC name is 3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide.

Molecular Properties

Compound Name3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide
PubChem CID18208620
Molecular FormulaC23H23NO2
Molecular Weight345.44 g/mol
Exact Mass345.17
IUPAC Name3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide
SMILESCOc1cc(C(=O)NC(c2ccccc2)c2ccc(C)cc2)ccc1C
InChIInChI=1S/C23H23NO2/c1-16-9-12-19(13-10-16)22(18-7-5-4-6-8-18)24-23(25)20-14-11-17(2)21(15-20)26-3/h4-15,22H,1-3H3,(H,24,25)
InChIKeyZYBDEESXLPZAIB-UHFFFAOYSA-N
XLogP4.83
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methoxy-3-methyl-N-[(R)-(4-methylphenyl)-phenylmethyl]benzamide
CID 100771245
3-methoxy-4-methyl-N-[(1S)-1-phenylethyl]benzamide
CID 26009148
N-benzhydryl-3,4-dimethylbenzamide
CID 1219840
4-methoxy-N-[(R)-(4-methylphenyl)-phenylmethyl]benzamide
CID 26174053
N-[(S)-(4-methylphenyl)-phenylmethyl]benzamide
CID 8798062
2,5-dimethyl-N-[(R)-(4-methylphenyl)-phenylmethyl]benzamide
CID 100743905
4-methyl-N-[(4-methylphenyl)-phenylmethyl]-3-(phenylsulfamoyl)benzamide
CID 43909814
N-[(2R)-2-hydroxy-2-phenylethyl]-3-methoxy-4-methylbenzamide
CID 93033692
N-[(4-methoxyphenyl)-phenylmethyl]-4-methyl-3-sulfamoylbenzamide
CID 78840747
2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide
CID 9118748
3-methoxy-4-methyl-N-(4-methylphenyl)benzamide
CID 9071746
3-methoxy-4-methyl-N-(3-methyl-2-phenylbutyl)benzamide
CID 46441342

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide?
The IUPAC name of 3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide (CID 18208620) is 3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide.
What is the SMILES notation for 3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide?
The canonical SMILES for 3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide is COc1cc(C(=O)NC(c2ccccc2)c2ccc(C)cc2)ccc1C.
What is the InChIKey of 3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide?
The InChIKey is ZYBDEESXLPZAIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO2/c1-16-9-12-19(13-10-16)22(18-7-5-4-6-8-18)24-23(25)20-14-11-17(2)21(15-20)26-3/h4-15,22H,1-3H3,(H,24,25).
What are the key properties of 3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide?
3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide has a molecular weight of 345.44 g/mol, XLogP of 4.83, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-4-methyl-N-[(4-methylphenyl)-phenylmethyl]benzamide is sourced from PubChem (CID 18208620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).