N-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide

C19H19N3O2 — CID 78856855

IUPACN-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide
SMILESCC(CO)NC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1
InChIInChI=1S/C19H19N3O2/c1-14(13-23)20-19(24)17-12-22(16-10-6-3-7-11-16)21-18(17)15-8-4-2-5-9-15/h2-12,14,23H,13H2,1H3,(H,20,24)
InChIKeyRBGXOUGXQAWZCU-UHFFFAOYSA-N
MW321.38 g/mol
LogP2.65
Rot. Bonds5

About N-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide

N-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide (PubChem CID 78856855) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is N-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide
PubChem CID78856855
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC NameN-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide
SMILESCC(CO)NC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1
InChIInChI=1S/C19H19N3O2/c1-14(13-23)20-19(24)17-12-22(16-10-6-3-7-11-16)21-18(17)15-8-4-2-5-9-15/h2-12,14,23H,13H2,1H3,(H,20,24)
InChIKeyRBGXOUGXQAWZCU-UHFFFAOYSA-N
XLogP2.65
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-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

3-(4-chlorophenyl)-N-(1-methoxypropan-2-yl)-1-phenylpyrazole-4-carboxamide
CID 42988922
N-[(2R)-1-oxo-1-(propylamino)propan-2-yl]-1,3-diphenylpyrazole-4-carboxamide
CID 9227685
3-(4-chlorophenyl)-N-[(2S)-1-hydroxybutan-2-yl]-1-phenylpyrazole-4-carboxamide
CID 7721800
1,3-diphenyl-N-(1-pyridin-4-ylethyl)pyrazole-4-carboxamide
CID 78775903
N-[(1S)-1-(furan-2-yl)ethyl]-1,3-diphenylpyrazole-4-carboxamide
CID 9481788
N-(3-hydroxybutyl)-1,3-diphenylpyrazole-4-carboxamide
CID 111429323
3-(3-methoxyphenyl)-N-pentan-2-yl-1-phenylpyrazole-4-carboxamide
CID 42988857
N-[1-(4-methylphenyl)propyl]-1,3-diphenylpyrazole-4-carboxamide
CID 19281297
N'-[(3R)-3-methylpent-1-en-2-yl]-1,3-diphenylpyrazole-4-carbohydrazide
CID 2357068
N-[2-(dimethylamino)-3-methylbutyl]-1,3-diphenylpyrazole-4-carboxamide
CID 24650106
1-phenyl-N-(1-pyrazol-1-ylpropan-2-yl)-3-pyridin-3-ylpyrazole-4-carboxamide
CID 47026926
N-[(1S)-1-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-1,3-diphenylpyrazole-4-carboxamide
CID 98284311

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide?
The IUPAC name of N-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide (CID 78856855) is N-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide.
What is the SMILES notation for N-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide?
The canonical SMILES for N-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide is CC(CO)NC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1.
What is the InChIKey of N-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide?
The InChIKey is RBGXOUGXQAWZCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-14(13-23)20-19(24)17-12-22(16-10-6-3-7-11-16)21-18(17)15-8-4-2-5-9-15/h2-12,14,23H,13H2,1H3,(H,20,24).
What are the key properties of N-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide?
N-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide has a molecular weight of 321.38 g/mol, XLogP of 2.65, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxypropan-2-yl)-1,3-diphenylpyrazole-4-carboxamide is sourced from PubChem (CID 78856855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).