3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide

C16H14F3N5O — CID 19513170

IUPAC3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide
SMILESCc1ccc(-c2cc(C(=O)Nc3c(C(F)(F)F)n[nH]c3C)[nH]n2)cc1
InChIInChI=1S/C16H14F3N5O/c1-8-3-5-10(6-4-8)11-7-12(23-22-11)15(25)20-13-9(2)21-24-14(13)16(17,18)19/h3-7H,1-2H3,(H,20,25)(H,21,24)(H,22,23)
InChIKeyGALJCGDCUJDRER-UHFFFAOYSA-N
MW349.32 g/mol
LogP3.69
Rot. Bonds3

About 3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide

3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide (PubChem CID 19513170) has the molecular formula C16H14F3N5O and a molecular weight of 349.32 g/mol. Its IUPAC name is 3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide
PubChem CID19513170
Molecular FormulaC16H14F3N5O
Molecular Weight349.32 g/mol
Exact Mass349.12
IUPAC Name3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide
SMILESCc1ccc(-c2cc(C(=O)Nc3c(C(F)(F)F)n[nH]c3C)[nH]n2)cc1
InChIInChI=1S/C16H14F3N5O/c1-8-3-5-10(6-4-8)11-7-12(23-22-11)15(25)20-13-9(2)21-24-14(13)16(17,18)19/h3-7H,1-2H3,(H,20,25)(H,21,24)(H,22,23)
InChIKeyGALJCGDCUJDRER-UHFFFAOYSA-N
XLogP3.69
TPSA86.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.32
LogP ≤ 53.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-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

N-(3,5-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 45030468
3-(4-methylphenyl)-N-pyridin-4-yl-1H-pyrazole-5-carboxamide
CID 19510252
3-(4-chlorophenyl)-N-(4-methylphenyl)-1H-pyrazole-5-carboxamide
CID 45030405
N-(2-bromo-4-methylphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 45030513
3-phenyl-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]-1H-pyrazole-5-carboxamide
CID 36580295
3-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-1H-pyrazole-5-carboxamide
CID 19514461
3-(4-chlorophenyl)-N-(2,5-dimethylphenyl)-1H-pyrazole-5-carboxamide
CID 19509413
N-(3,5-dimethoxyphenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 45030480
N-(2-fluoro-5-methylphenyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 19508782
N-(3,5-difluorophenyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 45030497
N-(2,4-dimethoxyphenyl)-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
CID 30000054
N-(4-chloro-2,5-dimethoxyphenyl)-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
CID 26069017

Frequently Asked Questions

What is the IUPAC name of 3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide?
The IUPAC name of 3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide (CID 19513170) is 3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide?
The canonical SMILES for 3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide is Cc1ccc(-c2cc(C(=O)Nc3c(C(F)(F)F)n[nH]c3C)[nH]n2)cc1.
What is the InChIKey of 3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide?
The InChIKey is GALJCGDCUJDRER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3N5O/c1-8-3-5-10(6-4-8)11-7-12(23-22-11)15(25)20-13-9(2)21-24-14(13)16(17,18)19/h3-7H,1-2H3,(H,20,25)(H,21,24)(H,22,23).
What are the key properties of 3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide?
3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide has a molecular weight of 349.32 g/mol, XLogP of 3.69, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylphenyl)-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 19513170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).