N'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide

C24H20N4O2 — CID 4787905

IUPACN'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide
SMILESO=C(NNC(=O)C(c1ccccc1)c1ccccc1)c1cc(-c2ccccc2)n[nH]1
InChIInChI=1S/C24H20N4O2/c29-23(21-16-20(25-26-21)17-10-4-1-5-11-17)27-28-24(30)22(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16,22H,(H,25,26)(H,27,29)(H,28,30)
InChIKeyPRKWECYYKMABTI-UHFFFAOYSA-N
MW396.45 g/mol
LogP3.67
Rot. Bonds5

About N'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide

N'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide (PubChem CID 4787905) has the molecular formula C24H20N4O2 and a molecular weight of 396.45 g/mol. Its IUPAC name is N'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide.

Molecular Properties

Compound NameN'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide
PubChem CID4787905
Molecular FormulaC24H20N4O2
Molecular Weight396.45 g/mol
Exact Mass396.16
IUPAC NameN'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide
SMILESO=C(NNC(=O)C(c1ccccc1)c1ccccc1)c1cc(-c2ccccc2)n[nH]1
InChIInChI=1S/C24H20N4O2/c29-23(21-16-20(25-26-21)17-10-4-1-5-11-17)27-28-24(30)22(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16,22H,(H,25,26)(H,27,29)(H,28,30)
InChIKeyPRKWECYYKMABTI-UHFFFAOYSA-N
XLogP3.67
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.45
LogP ≤ 53.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-(2-hydroxybenzoyl)-3-phenyl-1H-pyrazole-5-carbohydrazide
CID 27698464
3-phenyl-N'-propanoyl-1H-pyrazole-5-carbohydrazide
CID 2677236
N'-(2-bromobenzoyl)-3-phenyl-1H-pyrazole-5-carbohydrazide
CID 27672307
3-phenyl-N'-(thiophene-3-carbonyl)-1H-pyrazole-5-carbohydrazide
CID 40671857
bis(3-phenyl-1H-pyrazol-5-yl)methanone
CID 174669259
N'-(3-methylbenzoyl)-3-phenyl-1H-pyrazole-5-carbohydrazide
CID 26823847
6-oxo-N'-(3-phenyl-1H-pyrazole-5-carbonyl)-4,5-dihydro-1H-pyridazine-3-carbohydrazide
CID 4845852
N'-(2,5-dimethylthiophene-3-carbonyl)-3-phenyl-1H-pyrazole-5-carbohydrazide
CID 17486234
1-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]-3-(4-propan-2-ylphenyl)thiourea
CID 8889246
N-(4-acetamidophenyl)-3-phenyl-1H-pyrazole-5-carboxamide
CID 26273244
N'-(3-methylsulfanylpropanoyl)-3-phenyl-1H-pyrazole-5-carbohydrazide
CID 18164415
4-bromo-N-[2-oxo-2-[2-(3-phenyl-1H-pyrazole-5-carbonyl)hydrazinyl]ethyl]benzamide
CID 35945015

Frequently Asked Questions

What is the IUPAC name of N'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide?
The IUPAC name of N'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide (CID 4787905) is N'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide.
What is the SMILES notation for N'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide?
The canonical SMILES for N'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide is O=C(NNC(=O)C(c1ccccc1)c1ccccc1)c1cc(-c2ccccc2)n[nH]1.
What is the InChIKey of N'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide?
The InChIKey is PRKWECYYKMABTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O2/c29-23(21-16-20(25-26-21)17-10-4-1-5-11-17)27-28-24(30)22(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16,22H,(H,25,26)(H,27,29)(H,28,30).
What are the key properties of N'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide?
N'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide has a molecular weight of 396.45 g/mol, XLogP of 3.67, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,2-diphenylacetyl)-3-phenyl-1H-pyrazole-5-carbohydrazide is sourced from PubChem (CID 4787905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).