2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide

C23H24N2O4 — CID 3461826

IUPAC2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide
SMILESCOc1cc(NC(=O)Cn2c(-c3ccccc3)cc(C(C)=O)c2C)cc(OC)c1
InChIInChI=1S/C23H24N2O4/c1-15-21(16(2)26)13-22(17-8-6-5-7-9-17)25(15)14-23(27)24-18-10-19(28-3)12-20(11-18)29-4/h5-13H,14H2,1-4H3,(H,24,27)
InChIKeyOZJMTQDFQRSHAZ-UHFFFAOYSA-N
MW392.46 g/mol
LogP4.32
Rot. Bonds7

About 2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide

2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide (PubChem CID 3461826) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is 2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide
PubChem CID3461826
Molecular FormulaC23H24N2O4
Molecular Weight392.46 g/mol
Exact Mass392.17
IUPAC Name2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide
SMILESCOc1cc(NC(=O)Cn2c(-c3ccccc3)cc(C(C)=O)c2C)cc(OC)c1
InChIInChI=1S/C23H24N2O4/c1-15-21(16(2)26)13-22(17-8-6-5-7-9-17)25(15)14-23(27)24-18-10-19(28-3)12-20(11-18)29-4/h5-13H,14H2,1-4H3,(H,24,27)
InChIKeyOZJMTQDFQRSHAZ-UHFFFAOYSA-N
XLogP4.32
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-((3,5-dimethoxyphenyl)amino)-1-(1H-indol-3-yl)-2-phenylethanone
CID 42916879
2-(3-Cyclopropanecarbonyl-indol-1-yl)-N-(3-methoxy-phenyl)-acetamide
CID 965857
N-(3,5-dimethoxyphenyl)-3-phenyl-2-(1H-pyrrol-1-yl)propanamide
CID 6619890
N-(3-(4-(3-Methoxyphenyl)piperazin-1-yl)propyl)-2-methyl-5-phenyl-1-propyl-1H-pyrrole-3-carboxamide
CID 49863774
4-(3,5-dimethoxyanilino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one
CID 53494126
[4-(3,5-Dimethoxyphenyl)piperazin-1-yl]-(2-methyl-4-phenyl-1,3-oxazol-5-yl)methanone
CID 71511354
[4-(3,5-Dimethoxyphenyl)piperazin-1-yl]-(3-methyl-4-phenyl-1,2-oxazol-5-yl)methanone
CID 72736710
N-(3-methoxyphenyl)-2-[2-methyl-3-(trifluoroacetyl)-1H-indol-1-yl]acetamide
CID 2190763
2-(3-acetyl-2-methyl-1H-indol-1-yl)-N-(3-methoxyphenyl)acetamide
CID 2228390
Ethyl 1-{[(2-ethoxyphenyl)carbamoyl]methyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
CID 3397649
N-(3-methoxyphenyl)-2-oxo-2-{1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-indol-3-yl}acetamide
CID 3514051
ethyl 1-[2-(4-methoxy-N-methylanilino)-2-oxoethyl]-2-methyl-5-phenylpyrrole-3-carboxylate
CID 3580045

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide?
The IUPAC name of 2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide (CID 3461826) is 2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide.
What is the SMILES notation for 2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide?
The canonical SMILES for 2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide is COc1cc(NC(=O)Cn2c(-c3ccccc3)cc(C(C)=O)c2C)cc(OC)c1.
What is the InChIKey of 2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide?
The InChIKey is OZJMTQDFQRSHAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4/c1-15-21(16(2)26)13-22(17-8-6-5-7-9-17)25(15)14-23(27)24-18-10-19(28-3)12-20(11-18)29-4/h5-13H,14H2,1-4H3,(H,24,27).
What are the key properties of 2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide?
2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide has a molecular weight of 392.46 g/mol, XLogP of 4.32, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(3,5-dimethoxyphenyl)acetamide is sourced from PubChem (CID 3461826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).