N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide

C13H15N3O — CID 134060372

IUPACN-(4-methylphenyl)-2-pyrazol-1-ylpropanamide
SMILESCc1ccc(NC(=O)C(C)n2cccn2)cc1
InChIInChI=1S/C13H15N3O/c1-10-4-6-12(7-5-10)15-13(17)11(2)16-9-3-8-14-16/h3-9,11H,1-2H3,(H,15,17)
InChIKeyPIUFLVJZYFOCNX-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.39
Rot. Bonds3

About N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide

N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide (PubChem CID 134060372) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-2-pyrazol-1-ylpropanamide
PubChem CID134060372
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC NameN-(4-methylphenyl)-2-pyrazol-1-ylpropanamide
SMILESCc1ccc(NC(=O)C(C)n2cccn2)cc1
InChIInChI=1S/C13H15N3O/c1-10-4-6-12(7-5-10)15-13(17)11(2)16-9-3-8-14-16/h3-9,11H,1-2H3,(H,15,17)
InChIKeyPIUFLVJZYFOCNX-UHFFFAOYSA-N
XLogP2.39
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-phenyl-2-pyrazol-1-ylpropanamide
CID 42949018
N-(4-cyanophenyl)-2-pyrazol-1-ylpropanamide
CID 43187532
N-(3-acetamidophenyl)-2-pyrazol-1-ylpropanamide
CID 134060380
N-(6-amino-3-pyridinyl)-2-pyrazol-1-ylpropanamide
CID 55130465
N-(2,6-dimethylphenyl)-2-pyrazol-1-ylpropanamide
CID 47156281
N-[4-(4-methylpiperazin-1-yl)phenyl]-2-pyrazol-1-ylpropanamide
CID 134048457
N-(4-bromo-3,5-dimethylphenyl)-2-pyrazol-1-ylpropanamide
CID 106491100
2-hydroxy-4-(2-pyrazol-1-ylpropanoylamino)benzoic acid
CID 43211185
N-(4-methyl-3-nitrophenyl)-2-pyrazol-1-ylpropanamide
CID 47156473
N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide
CID 47187700
N-(2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide
CID 42949038
(2S)-N-[4-[[4-(diethylamino)-6-methylpyrimidin-2-yl]amino]phenyl]-2-pyrazol-1-ylpropanamide
CID 122288447

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide?
The IUPAC name of N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide (CID 134060372) is N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide?
The canonical SMILES for N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide is Cc1ccc(NC(=O)C(C)n2cccn2)cc1.
What is the InChIKey of N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide?
The InChIKey is PIUFLVJZYFOCNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-10-4-6-12(7-5-10)15-13(17)11(2)16-9-3-8-14-16/h3-9,11H,1-2H3,(H,15,17).
What are the key properties of N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide?
N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide has a molecular weight of 229.28 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 134060372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).