2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide

C24H26N2O3 — CID 42852610

IUPAC2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide
SMILESCOc1ccc(OC)c(CNc2ccc(CC(=O)Nc3cccc(C)c3)cc2)c1
InChIInChI=1S/C24H26N2O3/c1-17-5-4-6-21(13-17)26-24(27)14-18-7-9-20(10-8-18)25-16-19-15-22(28-2)11-12-23(19)29-3/h4-13,15,25H,14,16H2,1-3H3,(H,26,27)
InChIKeyVCHBLIFSTUUIBC-UHFFFAOYSA-N
MW390.48 g/mol
LogP4.81
Rot. Bonds8

About 2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide

2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide (PubChem CID 42852610) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is 2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide
PubChem CID42852610
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC Name2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide
SMILESCOc1ccc(OC)c(CNc2ccc(CC(=O)Nc3cccc(C)c3)cc2)c1
InChIInChI=1S/C24H26N2O3/c1-17-5-4-6-21(13-17)26-24(27)14-18-7-9-20(10-8-18)25-16-19-15-22(28-2)11-12-23(19)29-3/h4-13,15,25H,14,16H2,1-3H3,(H,26,27)
InChIKeyVCHBLIFSTUUIBC-UHFFFAOYSA-N
XLogP4.81
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.48
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxy-5-methylphenyl)-N-(3-methylphenyl)acetamide
CID 9039136
2-(2,5-dimethoxyphenyl)-N-[4-(3-methylphenoxy)phenyl]acetamide
CID 7581668
2-(4-methoxy-3-methylphenyl)-N-(3-methylphenyl)acetamide
CID 16848486
2-(2,5-dimethoxyphenyl)-N-(3,4-dimethylphenyl)acetamide
CID 78804402
N-(3-methylphenyl)-2-[4-[(3-phenoxyphenyl)methylamino]phenyl]acetamide
CID 46045434
methyl 3-[[2-(2,5-dimethoxyphenyl)acetyl]amino]benzoate
CID 110766971
2-(2,5-dimethoxyphenyl)-N-naphthalen-2-ylacetamide
CID 78804408
N-(3,4-dimethoxyphenyl)-2-(3-methylphenyl)acetamide
CID 9497409
2-[4-methoxy-2-(trifluoromethyl)phenyl]-N-(3-methylphenyl)acetamide
CID 71078628
2-[4-[(4-methoxyphenyl)methylamino]phenyl]-N-[(3-methylphenyl)methyl]acetamide
CID 42852652
N-tert-butyl-3-[[2-(2,5-dimethoxyphenyl)acetyl]amino]benzamide
CID 78890966
2-(4-bromophenyl)-N-(3-methoxyphenyl)acetamide
CID 2205638

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide (CID 42852610) is 2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide is COc1ccc(OC)c(CNc2ccc(CC(=O)Nc3cccc(C)c3)cc2)c1.
What is the InChIKey of 2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide?
The InChIKey is VCHBLIFSTUUIBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3/c1-17-5-4-6-21(13-17)26-24(27)14-18-7-9-20(10-8-18)25-16-19-15-22(28-2)11-12-23(19)29-3/h4-13,15,25H,14,16H2,1-3H3,(H,26,27).
What are the key properties of 2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide?
2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide has a molecular weight of 390.48 g/mol, XLogP of 4.81, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(2,5-dimethoxyphenyl)methylamino]phenyl]-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 42852610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).