4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide

C23H22N2O2 — CID 166367703

IUPAC4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide
SMILESCc1ccc(C(N)=O)cc1C(=O)NCCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H22N2O2/c1-16-7-10-20(22(24)26)15-21(16)23(27)25-14-13-17-8-11-19(12-9-17)18-5-3-2-4-6-18/h2-12,15H,13-14H2,1H3,(H2,24,26)(H,25,27)
InChIKeyHQUZSZOBFLPTMK-UHFFFAOYSA-N
MW358.44 g/mol
LogP3.73
Rot. Bonds6

About 4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide

4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide (PubChem CID 166367703) has the molecular formula C23H22N2O2 and a molecular weight of 358.44 g/mol. Its IUPAC name is 4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide.

Molecular Properties

Compound Name4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide
PubChem CID166367703
Molecular FormulaC23H22N2O2
Molecular Weight358.44 g/mol
Exact Mass358.17
IUPAC Name4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide
SMILESCc1ccc(C(N)=O)cc1C(=O)NCCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H22N2O2/c1-16-7-10-20(22(24)26)15-21(16)23(27)25-14-13-17-8-11-19(12-9-17)18-5-3-2-4-6-18/h2-12,15H,13-14H2,1H3,(H2,24,26)(H,25,27)
InChIKeyHQUZSZOBFLPTMK-UHFFFAOYSA-N
XLogP3.73
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-amino-2,4-dimethyl-N-(2-phenylethyl)benzamide
CID 102704827
5-chloro-2-hydroxy-N-[2-(4-phenylphenyl)ethyl]benzamide
CID 90932345
1-[4-(4-acetylphenyl)phenyl]ethanone;4-(4-acetylphenyl)-N-(2-phenylethyl)benzamide
CID 91489702
3-[4-[2-(benzylamino)ethyl]phenyl]benzamide
CID 58276622
N-[2-(4-aminophenyl)ethyl]-5-fluoro-2-methylbenzamide
CID 63048750
2,3,4-trimethyl-N-(2-phenylethyl)benzamide
CID 84533517
1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide
CID 984633
2,5-dimethyl-N-(3-phenylpropyl)benzamide
CID 2202785
1-amino-3-[2-(4-phenylphenyl)ethyl]urea
CID 115192894
4-(4-hydroxy-3,5-dimethylphenyl)benzoic acid;N-[2-(4-hydroxy-3,5-dimethylphenyl)ethyl]benzamide
CID 91471780
2,3-dimethyl-N-(2-phenylethyl)benzamide
CID 7732731
2-amino-5-methyl-N-(2-phenylethyl)benzamide
CID 62073277

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide?
The IUPAC name of 4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide (CID 166367703) is 4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide.
What is the SMILES notation for 4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide?
The canonical SMILES for 4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide is Cc1ccc(C(N)=O)cc1C(=O)NCCc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide?
The InChIKey is HQUZSZOBFLPTMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O2/c1-16-7-10-20(22(24)26)15-21(16)23(27)25-14-13-17-8-11-19(12-9-17)18-5-3-2-4-6-18/h2-12,15H,13-14H2,1H3,(H2,24,26)(H,25,27).
What are the key properties of 4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide?
4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide has a molecular weight of 358.44 g/mol, XLogP of 3.73, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-N-[2-(4-phenylphenyl)ethyl]benzene-1,3-dicarboxamide is sourced from PubChem (CID 166367703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).