2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide

C23H23NO2 — CID 100708399

IUPAC2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide
SMILESCc1cc(C)c(C(=O)Nc2ccc(OCc3ccccc3)cc2)cc1C
InChIInChI=1S/C23H23NO2/c1-16-13-18(3)22(14-17(16)2)23(25)24-20-9-11-21(12-10-20)26-15-19-7-5-4-6-8-19/h4-14H,15H2,1-3H3,(H,24,25)
InChIKeyAZNGSNXCZPSLCA-UHFFFAOYSA-N
MW345.44 g/mol
LogP5.44
Rot. Bonds5

About 2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide

2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide (PubChem CID 100708399) has the molecular formula C23H23NO2 and a molecular weight of 345.44 g/mol. Its IUPAC name is 2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide.

Molecular Properties

Compound Name2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide
PubChem CID100708399
Molecular FormulaC23H23NO2
Molecular Weight345.44 g/mol
Exact Mass345.17
IUPAC Name2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide
SMILESCc1cc(C)c(C(=O)Nc2ccc(OCc3ccccc3)cc2)cc1C
InChIInChI=1S/C23H23NO2/c1-16-13-18(3)22(14-17(16)2)23(25)24-20-9-11-21(12-10-20)26-15-19-7-5-4-6-8-19/h4-14H,15H2,1-3H3,(H,24,25)
InChIKeyAZNGSNXCZPSLCA-UHFFFAOYSA-N
XLogP5.44
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.44
LogP ≤ 55.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-phenylmethoxyphenyl)carbamoyl]benzoate
CID 7033170
2-iodo-N-(4-phenylmethoxyphenyl)benzamide
CID 615692
4-ethoxy-3-methyl-N-(4-phenylmethoxyphenyl)benzamide
CID 30147613
2,3-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 27650117
N-(4-phenylmethoxyphenyl)naphthalene-1-carboxamide
CID 1336313
3,5-dimethoxy-4-phenylmethoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 139779676
2-(3,4-dimethylphenoxy)-N-(4-phenylmethoxyphenyl)acetamide
CID 4947508
3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 2791610
5-bromo-2-chloro-N-(4-phenylmethoxyphenyl)benzamide
CID 2953641
2-methyl-N-[2-oxo-2-(4-phenylmethoxyanilino)ethyl]benzamide
CID 92532530
N-[4-methyl-3-(methylsulfamoyl)phenyl]-4-phenylmethoxybenzamide
CID 9107189
N-[4-(2-methylpropoxy)phenyl]-4-phenylmethoxybenzamide
CID 4958406

Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide?
The IUPAC name of 2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide (CID 100708399) is 2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide.
What is the SMILES notation for 2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide?
The canonical SMILES for 2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide is Cc1cc(C)c(C(=O)Nc2ccc(OCc3ccccc3)cc2)cc1C.
What is the InChIKey of 2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide?
The InChIKey is AZNGSNXCZPSLCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO2/c1-16-13-18(3)22(14-17(16)2)23(25)24-20-9-11-21(12-10-20)26-15-19-7-5-4-6-8-19/h4-14H,15H2,1-3H3,(H,24,25).
What are the key properties of 2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide?
2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide has a molecular weight of 345.44 g/mol, XLogP of 5.44, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethyl-N-(4-phenylmethoxyphenyl)benzamide is sourced from PubChem (CID 100708399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).