N-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide

C24H25NO2 — CID 1226229

IUPACN-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide
SMILESCCc1ccc(OCc2ccc(C(=O)Nc3c(C)cccc3C)cc2)cc1
InChIInChI=1S/C24H25NO2/c1-4-19-10-14-22(15-11-19)27-16-20-8-12-21(13-9-20)24(26)25-23-17(2)6-5-7-18(23)3/h5-15H,4,16H2,1-3H3,(H,25,26)
InChIKeyIRZGGPKQLQGRMM-UHFFFAOYSA-N
MW359.47 g/mol
LogP5.70
Rot. Bonds6

About N-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide

N-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide (PubChem CID 1226229) has the molecular formula C24H25NO2 and a molecular weight of 359.47 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide
PubChem CID1226229
Molecular FormulaC24H25NO2
Molecular Weight359.47 g/mol
Exact Mass359.19
IUPAC NameN-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide
SMILESCCc1ccc(OCc2ccc(C(=O)Nc3c(C)cccc3C)cc2)cc1
InChIInChI=1S/C24H25NO2/c1-4-19-10-14-22(15-11-19)27-16-20-8-12-21(13-9-20)24(26)25-23-17(2)6-5-7-18(23)3/h5-15H,4,16H2,1-3H3,(H,25,26)
InChIKeyIRZGGPKQLQGRMM-UHFFFAOYSA-N
XLogP5.70
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.47
LogP ≤ 55.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-ethylphenyl)-4-(phenoxymethyl)benzamide
CID 2195613
N-(2,6-dimethylphenyl)-3-(4-ethylphenoxy)propanamide
CID 108795911
N-(2,3-dimethylphenyl)-4-(phenoxymethyl)benzamide
CID 7946940
[2-(2,6-dimethylanilino)-2-oxoethyl] 4-phenylmethoxybenzoate
CID 7264252
4-ethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 2701404
4-[(4-ethylphenoxy)methyl]benzoic acid
CID 585022
N-(4-amino-2,6-dimethylphenyl)-4-ethylbenzamide
CID 50880299
4-[(3,4-dimethylphenoxy)methyl]-N-(2-ethylphenyl)benzamide
CID 1303331
N-[2-[[2-(2,6-dimethylanilino)-2-oxoethyl]amino]-2-oxoethyl]-4-ethoxybenzamide
CID 7676792
1-(4-ethylphenyl)-3-[[4-(phenoxymethyl)benzoyl]amino]thiourea
CID 8616375
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide
CID 55865615
N-(6-methyl-2-pyridinyl)-4-phenylmethoxybenzamide
CID 35036020

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide?
The IUPAC name of N-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide (CID 1226229) is N-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide is CCc1ccc(OCc2ccc(C(=O)Nc3c(C)cccc3C)cc2)cc1.
What is the InChIKey of N-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide?
The InChIKey is IRZGGPKQLQGRMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO2/c1-4-19-10-14-22(15-11-19)27-16-20-8-12-21(13-9-20)24(26)25-23-17(2)6-5-7-18(23)3/h5-15H,4,16H2,1-3H3,(H,25,26).
What are the key properties of N-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide?
N-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide has a molecular weight of 359.47 g/mol, XLogP of 5.70, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-4-[(4-ethylphenoxy)methyl]benzamide is sourced from PubChem (CID 1226229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).