3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide

C23H23NO3 — CID 8880797

IUPAC3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide
SMILESCOc1ccc(CCC(=O)Nc2ccc(-c3ccccc3)cc2)cc1OC
InChIInChI=1S/C23H23NO3/c1-26-21-14-8-17(16-22(21)27-2)9-15-23(25)24-20-12-10-19(11-13-20)18-6-4-3-5-7-18/h3-8,10-14,16H,9,15H2,1-2H3,(H,24,25)
InChIKeyYIMHVPLHLJKPIX-UHFFFAOYSA-N
MW361.44 g/mol
LogP4.94
Rot. Bonds7

About 3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide

3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide (PubChem CID 8880797) has the molecular formula C23H23NO3 and a molecular weight of 361.44 g/mol. Its IUPAC name is 3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide.

Molecular Properties

Compound Name3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide
PubChem CID8880797
Molecular FormulaC23H23NO3
Molecular Weight361.44 g/mol
Exact Mass361.17
IUPAC Name3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide
SMILESCOc1ccc(CCC(=O)Nc2ccc(-c3ccccc3)cc2)cc1OC
InChIInChI=1S/C23H23NO3/c1-26-21-14-8-17(16-22(21)27-2)9-15-23(25)24-20-12-10-19(11-13-20)18-6-4-3-5-7-18/h3-8,10-14,16H,9,15H2,1-2H3,(H,24,25)
InChIKeyYIMHVPLHLJKPIX-UHFFFAOYSA-N
XLogP4.94
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.44
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3,4-dimethoxyphenyl)-N-(2-phenylphenyl)propanamide
CID 26727200
4-[3-(3,4-dimethoxyphenyl)propanoylamino]-N-hydroxybenzamide
CID 44516409
N-[4-(1H-benzimidazol-2-yl)phenyl]-3-(3,4-dimethoxyphenyl)propanamide
CID 2091179
3-(3,4-dimethoxyphenyl)-N-(4-ethylsulfonylphenyl)propanamide
CID 42021780
3-(3,4-dimethoxyphenyl)-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]propanamide
CID 19220711
N-(3,4-dichlorophenyl)-3-(3,4-dimethoxyphenyl)propanamide
CID 8759873
N-(4-butoxyphenyl)-3-(3,4-dimethoxyphenyl)propanamide
CID 19220649
3-(3,4-dimethoxyphenyl)-N-(2-hydroxyphenyl)propanamide
CID 12822107
N-(4-acetamidophenyl)-4-(3,4-dimethoxyphenyl)butanamide
CID 110423899
N-(3-bromophenyl)-3-(3,4-dimethoxyphenyl)propanamide
CID 9341227
3-(4-ethoxy-3-methoxyphenyl)-N-[4-(5-methyl-2-phenyl-1,3-thiazol-4-yl)phenyl]propanamide
CID 108747872
N-[4-(difluoromethylsulfanyl)phenyl]-3-(3,4-dimethoxyphenyl)propanamide
CID 2095031

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide?
The IUPAC name of 3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide (CID 8880797) is 3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide.
What is the SMILES notation for 3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide?
The canonical SMILES for 3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide is COc1ccc(CCC(=O)Nc2ccc(-c3ccccc3)cc2)cc1OC.
What is the InChIKey of 3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide?
The InChIKey is YIMHVPLHLJKPIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO3/c1-26-21-14-8-17(16-22(21)27-2)9-15-23(25)24-20-12-10-19(11-13-20)18-6-4-3-5-7-18/h3-8,10-14,16H,9,15H2,1-2H3,(H,24,25).
What are the key properties of 3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide?
3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide has a molecular weight of 361.44 g/mol, XLogP of 4.94, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide is sourced from PubChem (CID 8880797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).