3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole

C21H20N4O — CID 78427162

IUPAC3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole
SMILESCc1cc(COc2cc(C)nn2-c2ccccc2)n(-c2ccccc2)n1
InChIInChI=1S/C21H20N4O/c1-16-13-20(24(22-16)18-9-5-3-6-10-18)15-26-21-14-17(2)23-25(21)19-11-7-4-8-12-19/h3-14H,15H2,1-2H3
InChIKeyAKAXKIDEHNWBNG-UHFFFAOYSA-N
MW344.42 g/mol
LogP4.25
Rot. Bonds5

About 3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole

3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole (PubChem CID 78427162) has the molecular formula C21H20N4O and a molecular weight of 344.42 g/mol. Its IUPAC name is 3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole.

Molecular Properties

Compound Name3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole
PubChem CID78427162
Molecular FormulaC21H20N4O
Molecular Weight344.42 g/mol
Exact Mass344.16
IUPAC Name3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole
SMILESCc1cc(COc2cc(C)nn2-c2ccccc2)n(-c2ccccc2)n1
InChIInChI=1S/C21H20N4O/c1-16-13-20(24(22-16)18-9-5-3-6-10-18)15-26-21-14-17(2)23-25(21)19-11-7-4-8-12-19/h3-14H,15H2,1-2H3
InChIKeyAKAXKIDEHNWBNG-UHFFFAOYSA-N
XLogP4.25
TPSA44.87 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole 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

4-[2-[1-(4-Methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine
CID 11544226
4-[2-(5-Methyl-1-phenylpyrazol-3-yl)oxyethyl]morpholine
CID 71456959
5-Ethoxy-3-methyl-1-phenylpyrazole
CID 555100
Pyrazole, 5-(2-(dimethylamino)ethoxy)-3-methyl-1-phenyl-
CID 199978
N-[dimethylamino-(5-ethoxy-3-methyl-1-phenylpyrazol-4-yl)phosphinothioyl]-N-methylmethanamine
CID 2420535
3-Methyl-5-[2-(5-methyl-2-phenylpyrazol-3-yl)oxyethoxy]-1-phenylpyrazole
CID 78427164
3-Methyl-5-(3-methyl-1-phenyl-1H-pyrazol-5-yloxy)-1-phenyl-1H-pyrazol-4-amine
CID 78427165
3-Methyl-5-({[3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl]oxy}methyl)-1-phenyl-1H-pyrazole
CID 78427166
1-Benzyl-3-methyl-5-((3-methyl-1-phenyl-1H-pyrazol-5-yloxy)methyl)-1H-pyrazole
CID 78427167
1-(Cyclohexylmethyl)-3-methyl-5-((3-methyl-1-phenyl-1H-pyrazol-5-yl)methoxy)-1H-pyrazole
CID 78427293
1-Cyclopentyl-3-methyl-5-((3-methyl-1-phenyl-1H-pyrazol-5-yl)methoxy)-1H-pyrazole
CID 78427294
2-(3-Methyl-5-((3-methyl-1-phenyl-1H-pyrazol-5-yl)methoxy)-1H-pyrazol-1-yl)ethanamine
CID 78427295

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole?
The IUPAC name of 3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole (CID 78427162) is 3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole.
What is the SMILES notation for 3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole?
The canonical SMILES for 3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole is Cc1cc(COc2cc(C)nn2-c2ccccc2)n(-c2ccccc2)n1.
What is the InChIKey of 3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole?
The InChIKey is AKAXKIDEHNWBNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O/c1-16-13-20(24(22-16)18-9-5-3-6-10-18)15-26-21-14-17(2)23-25(21)19-11-7-4-8-12-19/h3-14H,15H2,1-2H3.
What are the key properties of 3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole?
3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole has a molecular weight of 344.42 g/mol, XLogP of 4.25, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]-1-phenylpyrazole is sourced from PubChem (CID 78427162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).