N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide

C25H26N6O4 — CID 55963533

IUPACN-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide
SMILESCCc1c(C(=O)Nc2ccc(NC(=O)CCN3C(=O)CNC3=O)cc2)cnn1-c1ccc(C)cc1
InChIInChI=1S/C25H26N6O4/c1-3-21-20(14-27-31(21)19-10-4-16(2)5-11-19)24(34)29-18-8-6-17(7-9-18)28-22(32)12-13-30-23(33)15-26-25(30)35/h4-11,14H,3,12-13,15H2,1-2H3,(H,26,35)(H,28,32)(H,29,34)
InChIKeyQBNKOUWEGOJGOO-UHFFFAOYSA-N
MW474.52 g/mol
LogP2.88
Rot. Bonds8

About N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide

N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide (PubChem CID 55963533) has the molecular formula C25H26N6O4 and a molecular weight of 474.52 g/mol. Its IUPAC name is N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide
PubChem CID55963533
Molecular FormulaC25H26N6O4
Molecular Weight474.52 g/mol
Exact Mass474.20
IUPAC NameN-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide
SMILESCCc1c(C(=O)Nc2ccc(NC(=O)CCN3C(=O)CNC3=O)cc2)cnn1-c1ccc(C)cc1
InChIInChI=1S/C25H26N6O4/c1-3-21-20(14-27-31(21)19-10-4-16(2)5-11-19)24(34)29-18-8-6-17(7-9-18)28-22(32)12-13-30-23(33)15-26-25(30)35/h4-11,14H,3,12-13,15H2,1-2H3,(H,26,35)(H,28,32)(H,29,34)
InChIKeyQBNKOUWEGOJGOO-UHFFFAOYSA-N
XLogP2.88
TPSA125.43 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500474.52
LogP ≤ 52.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide 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

5-ethyl-N,1-bis(4-methylphenyl)pyrazole-4-carboxamide
CID 46584156
N-(4-ethoxyphenyl)-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide
CID 46584032
N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-4-(4-methylphenyl)butanamide
CID 55963287
N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide
CID 55786497
N-(3-cyanophenyl)-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide
CID 46586204
5-ethyl-1-(4-methylphenyl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]pyrazole-4-carboxamide
CID 37437425
5-ethyl-1-(4-methylphenyl)-N-[[4-(2-methylpropanoylamino)phenyl]methyl]pyrazole-4-carboxamide
CID 55576435
N-(3,4-dimethylphenyl)-5-ethyl-1-phenylpyrazole-4-carboxamide
CID 46577913
5-ethyl-1-(4-fluorophenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)pyrazole-4-carboxamide
CID 55581735
5-ethyl-1-(4-methylphenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]pyrazole-4-carboxamide
CID 55676186
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide
CID 55581030
N'-benzoyl-5-ethyl-1-(4-methylphenyl)pyrazole-4-carbohydrazide
CID 46582435

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide?
The IUPAC name of N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide (CID 55963533) is N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide.
What is the SMILES notation for N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide?
The canonical SMILES for N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide is CCc1c(C(=O)Nc2ccc(NC(=O)CCN3C(=O)CNC3=O)cc2)cnn1-c1ccc(C)cc1.
What is the InChIKey of N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide?
The InChIKey is QBNKOUWEGOJGOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N6O4/c1-3-21-20(14-27-31(21)19-10-4-16(2)5-11-19)24(34)29-18-8-6-17(7-9-18)28-22(32)12-13-30-23(33)15-26-25(30)35/h4-11,14H,3,12-13,15H2,1-2H3,(H,26,35)(H,28,32)(H,29,34).
What are the key properties of N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide?
N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide has a molecular weight of 474.52 g/mol, XLogP of 2.88, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-(2,5-dioxoimidazolidin-1-yl)propanoylamino]phenyl]-5-ethyl-1-(4-methylphenyl)pyrazole-4-carboxamide is sourced from PubChem (CID 55963533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).