2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide

C19H16F3N3O — CID 162072635

IUPAC2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide
SMILESCc1cc(CC(=O)Nc2ccn(-c3ccccc3)n2)cc(C(F)(F)F)c1
InChIInChI=1S/C19H16F3N3O/c1-13-9-14(11-15(10-13)19(20,21)22)12-18(26)23-17-7-8-25(24-17)16-5-3-2-4-6-16/h2-11H,12H2,1H3,(H,23,24,26)
InChIKeyZBHHOXLACDFGMA-UHFFFAOYSA-N
MW359.35 g/mol
LogP4.38
Rot. Bonds4

About 2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide

2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide (PubChem CID 162072635) has the molecular formula C19H16F3N3O and a molecular weight of 359.35 g/mol. Its IUPAC name is 2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide
PubChem CID162072635
Molecular FormulaC19H16F3N3O
Molecular Weight359.35 g/mol
Exact Mass359.12
IUPAC Name2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide
SMILESCc1cc(CC(=O)Nc2ccn(-c3ccccc3)n2)cc(C(F)(F)F)c1
InChIInChI=1S/C19H16F3N3O/c1-13-9-14(11-15(10-13)19(20,21)22)12-18(26)23-17-7-8-25(24-17)16-5-3-2-4-6-16/h2-11H,12H2,1H3,(H,23,24,26)
InChIKeyZBHHOXLACDFGMA-UHFFFAOYSA-N
XLogP4.38
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.35
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)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-cyclopropyl-3-[1-(2,4-difluorophenyl)-7-methyl-6-oxo-6,7-dihydro-1H-pyrazolo[3,4-b]pyridin-5-yl]-4-methylbenzamide
CID 25118220
N-Cyclopropyl-3-(1-(2,4-difluorophenyl)-7-ethyl-6-oxo-6,7-dihydro-1H-pyrazolo[3,4-b]pyridin-5-yl)-4-methylbenzamide
CID 25119991
N-[1-[(3,4-difluorophenyl)methyl]pyrazol-3-yl]-2-[4-(dimethylamino)phenyl]acetamide
CID 118560409
2-[4-(3,3-difluorocyclobutyl)phenyl]-N-[1-[(3,4-difluorophenyl)methyl]pyrazol-3-yl]acetamide
CID 118560709
N-[1-[(3,4-difluorophenyl)methyl]pyrazol-3-yl]-2-(1-methylindazol-5-yl)acetamide
CID 126740623
3-fluoro-N-[3-methyl-1-(3-methylbenzyl)-1H-pyrazol-5-yl]benzamide
CID 1510958
N-(4-cyano-1-phenylpyrazol-5-yl)(2-fluorophenyl)carboxamide
CID 722799
3-trifluoromethyl-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide
CID 11675856
5-(4-Fluorophenyl)-3-phenylacetylamino-4-(4-pyridyl)pyrazole
CID 15513074
N-Cyclopropyl-3-(1-(2,5-difluorophenyl)-7-methyl-6-oxo-6,7-dihydro-1H-pyrazolo[3,4-b]pyridin-5-yl)-4-methylbenzamide
CID 25119294
Gsk-5498A
CID 46945384
5-(4-Fluorophenyl)-1-methyl-3-phenylacetylamino-4-(4-pyridyl)pyrazole
CID 69692723

Frequently Asked Questions

What is the IUPAC name of 2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide?
The IUPAC name of 2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide (CID 162072635) is 2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide is Cc1cc(CC(=O)Nc2ccn(-c3ccccc3)n2)cc(C(F)(F)F)c1.
What is the InChIKey of 2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide?
The InChIKey is ZBHHOXLACDFGMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F3N3O/c1-13-9-14(11-15(10-13)19(20,21)22)12-18(26)23-17-7-8-25(24-17)16-5-3-2-4-6-16/h2-11H,12H2,1H3,(H,23,24,26).
What are the key properties of 2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide?
2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide has a molecular weight of 359.35 g/mol, XLogP of 4.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-methyl-5-(trifluoromethyl)phenyl]-N-(1-phenylpyrazol-3-yl)acetamide is sourced from PubChem (CID 162072635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).