2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide

C19H18N4O3 — CID 124527773

IUPAC2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide
SMILESCCc1ccccc1NC(=O)C(=O)[C@@H]1C(=O)N(c2ccccc2)N=C1N
InChIInChI=1S/C19H18N4O3/c1-2-12-8-6-7-11-14(12)21-18(25)16(24)15-17(20)22-23(19(15)26)13-9-4-3-5-10-13/h3-11,15H,2H2,1H3,(H2,20,22)(H,21,25)/t15-/m0/s1
InChIKeyJGFPJQXISCLJJD-HNNXBMFYSA-N
MW350.38 g/mol
LogP1.69
Rot. Bonds5

About 2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide

2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide (PubChem CID 124527773) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is 2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide.

Molecular Properties

Compound Name2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide
PubChem CID124527773
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC Name2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide
SMILESCCc1ccccc1NC(=O)C(=O)[C@@H]1C(=O)N(c2ccccc2)N=C1N
InChIInChI=1S/C19H18N4O3/c1-2-12-8-6-7-11-14(12)21-18(25)16(24)15-17(20)22-23(19(15)26)13-9-4-3-5-10-13/h3-11,15H,2H2,1H3,(H2,20,22)(H,21,25)/t15-/m0/s1
InChIKeyJGFPJQXISCLJJD-HNNXBMFYSA-N
XLogP1.69
TPSA104.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze 2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide 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-ethoxyphenyl)-2-[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]-2-oxoacetamide
CID 98131505
N-(2-ethylphenyl)-2-oxo-1-phenylpyrrolidine-3-carboxamide
CID 20964176
2-[(4R)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]-2-oxo-N-[3-(trifluoromethyl)phenyl]acetamide
CID 124632165
2-(2-ethylanilino)-2-oxoacetyl chloride
CID 87858291
(4R)-4-butanoyl-5-methyl-2-phenyl-4H-pyrazol-3-one
CID 124577604
(4S)-4-butanoyl-5-methyl-2-phenyl-4H-pyrazol-3-one
CID 124577603
N-(2-acetylphenyl)-3-methyl-5-oxo-1-phenyl-4H-pyrazole-4-carboxamide
CID 139443142
N-(2-ethylphenyl)-2-methylprop-2-enamide
CID 54544779
N'-(2-carbamoylphenyl)-N-(2-ethylphenyl)oxamide
CID 108529346
N-(5-ethylthiophen-2-yl)-3-methyl-5-oxo-1-phenyl-4H-pyrazole-4-carboxamide
CID 139443009
1-(3-aminophenyl)-3-(2-ethylphenyl)urea
CID 30050716
N'-(2-ethylphenyl)-N-naphthalen-2-yloxamide
CID 108528326

Frequently Asked Questions

What is the IUPAC name of 2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide?
The IUPAC name of 2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide (CID 124527773) is 2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide.
What is the SMILES notation for 2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide?
The canonical SMILES for 2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide is CCc1ccccc1NC(=O)C(=O)[C@@H]1C(=O)N(c2ccccc2)N=C1N.
What is the InChIKey of 2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide?
The InChIKey is JGFPJQXISCLJJD-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H18N4O3/c1-2-12-8-6-7-11-14(12)21-18(25)16(24)15-17(20)22-23(19(15)26)13-9-4-3-5-10-13/h3-11,15H,2H2,1H3,(H2,20,22)(H,21,25)/t15-/m0/s1.
What are the key properties of 2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide?
2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide has a molecular weight of 350.38 g/mol, XLogP of 1.69, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4R)-3-amino-5-oxo-1-phenyl-4H-pyrazol-4-yl]-N-(2-ethylphenyl)-2-oxoacetamide is sourced from PubChem (CID 124527773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).