2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide

C23H21N5O3 — CID 11509899

IUPAC2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide
SMILESCc1ccc(NC(=O)c2nccnc2C(=O)Nc2ccc(N3CCCC3=O)cc2)cc1
InChIInChI=1S/C23H21N5O3/c1-15-4-6-16(7-5-15)26-22(30)20-21(25-13-12-24-20)23(31)27-17-8-10-18(11-9-17)28-14-2-3-19(28)29/h4-13H,2-3,14H2,1H3,(H,26,30)(H,27,31)
InChIKeyYPGKOCFEGLMPTD-UHFFFAOYSA-N
MW415.45 g/mol
LogP3.42
Rot. Bonds5

About 2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide

2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide (PubChem CID 11509899) has the molecular formula C23H21N5O3 and a molecular weight of 415.45 g/mol. Its IUPAC name is 2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide.

Molecular Properties

Compound Name2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide
PubChem CID11509899
Molecular FormulaC23H21N5O3
Molecular Weight415.45 g/mol
Exact Mass415.16
IUPAC Name2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide
SMILESCc1ccc(NC(=O)c2nccnc2C(=O)Nc2ccc(N3CCCC3=O)cc2)cc1
InChIInChI=1S/C23H21N5O3/c1-15-4-6-16(7-5-15)26-22(30)20-21(25-13-12-24-20)23(31)27-17-8-10-18(11-9-17)28-14-2-3-19(28)29/h4-13H,2-3,14H2,1H3,(H,26,30)(H,27,31)
InChIKeyYPGKOCFEGLMPTD-UHFFFAOYSA-N
XLogP3.42
TPSA104.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.45
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide 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

N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 7686436
2-[methyl-[2-oxo-2-[4-(2-oxopyrrolidin-1-yl)anilino]ethyl]amino]-N-(4-methylphenyl)acetamide
CID 8786075
3-(4-methylphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]thiophene-2-carboxamide
CID 27677053
4-acetamido-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 78788340
ethane;1-(4-methylphenyl)pyrrolidin-2-one
CID 143607645
3-[(4-chlorobenzoyl)amino]-N-[4-(2-oxopiperidin-1-yl)phenyl]pyrazine-2-carboxamide
CID 174461676
3-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1,2-oxazole-5-carboxamide
CID 17429991
2-amino-2-(4-methylphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide;hydrochloride
CID 120666734
4-(4-methylpyrazol-1-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 55774228
N-(4-acetylphenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 9242933
methyl 4-[[4-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]benzoate
CID 8747295
2-methoxy-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686423

Frequently Asked Questions

What is the IUPAC name of 2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide?
The IUPAC name of 2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide (CID 11509899) is 2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide.
What is the SMILES notation for 2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide?
The canonical SMILES for 2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide is Cc1ccc(NC(=O)c2nccnc2C(=O)Nc2ccc(N3CCCC3=O)cc2)cc1.
What is the InChIKey of 2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide?
The InChIKey is YPGKOCFEGLMPTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5O3/c1-15-4-6-16(7-5-15)26-22(30)20-21(25-13-12-24-20)23(31)27-17-8-10-18(11-9-17)28-14-2-3-19(28)29/h4-13H,2-3,14H2,1H3,(H,26,30)(H,27,31).
What are the key properties of 2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide?
2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide has a molecular weight of 415.45 g/mol, XLogP of 3.42, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide is sourced from PubChem (CID 11509899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).