N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide

C17H19NO2 — CID 3289325

IUPACN-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NCc2ccc(C)cc2C)cc1
InChIInChI=1S/C17H19NO2/c1-12-4-5-15(13(2)10-12)11-18-17(19)14-6-8-16(20-3)9-7-14/h4-10H,11H2,1-3H3,(H,18,19)
InChIKeyRSOUHKJULNYIAJ-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.24
Rot. Bonds4

About N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide

N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide (PubChem CID 3289325) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide
PubChem CID3289325
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC NameN-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NCc2ccc(C)cc2C)cc1
InChIInChI=1S/C17H19NO2/c1-12-4-5-15(13(2)10-12)11-18-17(19)14-6-8-16(20-3)9-7-14/h4-10H,11H2,1-3H3,(H,18,19)
InChIKeyRSOUHKJULNYIAJ-UHFFFAOYSA-N
XLogP3.24
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methoxy-N-[(2-methoxy-3,5-dimethylphenyl)methyl]benzamide
CID 110782841
N-[(2,4-dimethylphenyl)methyl]-3-ethoxy-4-methoxybenzamide
CID 46590873
N-[[4-methoxy-2-(trifluoromethyl)phenyl]methyl]-4-methylbenzamide
CID 163867885
4-benzamido-N-[(2,4-dimethylphenyl)methyl]benzamide
CID 46587607
N-[2-(2,4-dimethylanilino)-2-oxoethyl]-4-methoxybenzamide
CID 46755786
N-[2-[(4-methoxybenzoyl)amino]ethyl]-4-methylbenzamide
CID 108537787
1-N,4-N-bis[(2,5-dimethoxyphenyl)methyl]benzene-1,4-dicarboxamide
CID 46542093
4-(diethylsulfamoyl)-N-[(2,4-dimethylphenyl)methyl]benzamide
CID 46587666
3-[(2,4-dimethylphenyl)methyl]-1-[(1S)-2-hydroxy-1-(4-methoxyphenyl)ethyl]-1-methylurea
CID 97250367
(2S)-N-[(2,4-dimethylphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 55939174
4-methoxy-N-[[3-[[(4-methoxybenzoyl)amino]methyl]phenyl]methyl]benzamide
CID 4118576
N-[2-[(4-methoxybenzoyl)amino]ethyl]-3-methylbenzamide
CID 108537853

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide?
The IUPAC name of N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide (CID 3289325) is N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide.
What is the SMILES notation for N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide?
The canonical SMILES for N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide is COc1ccc(C(=O)NCc2ccc(C)cc2C)cc1.
What is the InChIKey of N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide?
The InChIKey is RSOUHKJULNYIAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-12-4-5-15(13(2)10-12)11-18-17(19)14-6-8-16(20-3)9-7-14/h4-10H,11H2,1-3H3,(H,18,19).
What are the key properties of N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide?
N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide has a molecular weight of 269.34 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide is sourced from PubChem (CID 3289325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).