N-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide

C23H23NO2 — CID 56933897

IUPACN-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide
SMILESCOc1cccc(CN(C)C(=O)c2ccc(-c3cccc(C)c3)cc2)c1
InChIInChI=1S/C23H23NO2/c1-17-6-4-8-21(14-17)19-10-12-20(13-11-19)23(25)24(2)16-18-7-5-9-22(15-18)26-3/h4-15H,16H2,1-3H3
InChIKeyLGIHQWVBULQIMC-UHFFFAOYSA-N
MW345.44 g/mol
LogP4.94
Rot. Bonds5

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

N-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide (PubChem CID 56933897) has the molecular formula C23H23NO2 and a molecular weight of 345.44 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide
PubChem CID56933897
Molecular FormulaC23H23NO2
Molecular Weight345.44 g/mol
Exact Mass345.17
IUPAC NameN-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide
SMILESCOc1cccc(CN(C)C(=O)c2ccc(-c3cccc(C)c3)cc2)c1
InChIInChI=1S/C23H23NO2/c1-17-6-4-8-21(14-17)19-10-12-20(13-11-19)23(25)24(2)16-18-7-5-9-22(15-18)26-3/h4-15H,16H2,1-3H3
InChIKeyLGIHQWVBULQIMC-UHFFFAOYSA-N
XLogP4.94
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide (CID 56933897) is N-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide is COc1cccc(CN(C)C(=O)c2ccc(-c3cccc(C)c3)cc2)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide?
The InChIKey is LGIHQWVBULQIMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO2/c1-17-6-4-8-21(14-17)19-10-12-20(13-11-19)23(25)24(2)16-18-7-5-9-22(15-18)26-3/h4-15H,16H2,1-3H3.
What are the key properties of N-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide?
N-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide has a molecular weight of 345.44 g/mol, XLogP of 4.94, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-N-methyl-4-(3-methylphenyl)benzamide is sourced from PubChem (CID 56933897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).