2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide

C20H21N3O2 — CID 110887930

IUPAC2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide
SMILESO=C(NCCCn1cccn1)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H21N3O2/c24-19(21-13-7-15-23-16-8-14-22-23)20(25,17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-6,8-12,14,16,25H,7,13,15H2,(H,21,24)
InChIKeySCMQYTITLDTEMQ-UHFFFAOYSA-N
MW335.41 g/mol
LogP2.33
Rot. Bonds7

About 2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide

2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide (PubChem CID 110887930) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is 2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide.

Molecular Properties

Compound Name2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide
PubChem CID110887930
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC Name2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide
SMILESO=C(NCCCn1cccn1)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H21N3O2/c24-19(21-13-7-15-23-16-8-14-22-23)20(25,17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-6,8-12,14,16,25H,7,13,15H2,(H,21,24)
InChIKeySCMQYTITLDTEMQ-UHFFFAOYSA-N
XLogP2.33
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)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

N-(10-pyrazol-1-yldecyl)benzamide
CID 14662167
tert-butyl N-(3-pyrazol-1-ylpropyl)carbamate
CID 69176267
N-(3-pyrazol-1-ylpropyl)pyridine-4-carboxamide
CID 35285072
2-(tert-butylamino)-N-(3-pyrazol-1-ylpropyl)acetamide
CID 112685077
4-[(E)-3-oxo-3-(3-pyrazol-1-ylpropylamino)prop-1-enyl]benzoic acid
CID 75469085
4-bromo-2,6-difluoro-N-(3-pyrazol-1-ylpropyl)benzamide
CID 115686657
2-(4-aminophenyl)-2-methyl-N-(2-pyrazol-1-ylethyl)propanamide
CID 80556949
3-methyl-N-(3-pyrazol-1-ylpropyl)benzamide
CID 19332230
1-(3-pyrazol-1-ylpropyl)-3-(2,2,2-trifluoroethyl)urea
CID 113223590
N-[2-oxo-1-phenyl-2-(3-pyrazol-1-ylpropylamino)ethyl]benzamide
CID 55912679
N-[2-[[N'-methyl-N-(3-pyrazol-1-ylpropyl)carbamimidoyl]amino]ethyl]benzamide;hydroiodide
CID 111904534
3-phenyl-N-(3-pyrazol-1-ylpropyl)furan-2-carboxamide
CID 37392558

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide?
The IUPAC name of 2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide (CID 110887930) is 2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide.
What is the SMILES notation for 2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide?
The canonical SMILES for 2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide is O=C(NCCCn1cccn1)C(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide?
The InChIKey is SCMQYTITLDTEMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c24-19(21-13-7-15-23-16-8-14-22-23)20(25,17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-6,8-12,14,16,25H,7,13,15H2,(H,21,24).
What are the key properties of 2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide?
2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide has a molecular weight of 335.41 g/mol, XLogP of 2.33, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2,2-diphenyl-N-(3-pyrazol-1-ylpropyl)acetamide is sourced from PubChem (CID 110887930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).