5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole

C24H22N6 — CID 101085773

IUPAC5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole
SMILESCc1cc(-c2ccccc2)nn1C(n1cccn1)n1nc(-c2ccccc2)cc1C
InChIInChI=1S/C24H22N6/c1-18-16-22(20-10-5-3-6-11-20)26-29(18)24(28-15-9-14-25-28)30-19(2)17-23(27-30)21-12-7-4-8-13-21/h3-17,24H,1-2H3
InChIKeyJHUJALPZPVVSBG-UHFFFAOYSA-N
MW394.48 g/mol
LogP4.78
Rot. Bonds5

About 5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole

5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole (PubChem CID 101085773) has the molecular formula C24H22N6 and a molecular weight of 394.48 g/mol. Its IUPAC name is 5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole.

Molecular Properties

Compound Name5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole
PubChem CID101085773
Molecular FormulaC24H22N6
Molecular Weight394.48 g/mol
Exact Mass394.19
IUPAC Name5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole
SMILESCc1cc(-c2ccccc2)nn1C(n1cccn1)n1nc(-c2ccccc2)cc1C
InChIInChI=1S/C24H22N6/c1-18-16-22(20-10-5-3-6-11-20)26-29(18)24(28-15-9-14-25-28)30-19(2)17-23(27-30)21-12-7-4-8-13-21/h3-17,24H,1-2H3
InChIKeyJHUJALPZPVVSBG-UHFFFAOYSA-N
XLogP4.78
TPSA53.46 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.48
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-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-(4-Methylphenyl)-1-[[4-(1-methylpyrazol-4-yl)phenyl]methyl]triazole
CID 152221091
1-Methyl-3-phenyl-1H-pyrazole
CID 137946
1-ethyl-3-methyl-4-[(3-methyl-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl)methyl]-1H-pyrazole
CID 2986538
1-[[4-(1-Methylpyrazol-4-yl)phenyl]methyl]-4-phenyltriazole
CID 151105657
1-[3-(2-fluorophenyl)-1-methyl-1H-pyrazol-4-yl]-N-methyl-N-[3-(1H-pyrazol-1-yl)benzyl]methanamine
CID 16188349
2-(3,5-dimethyl-1H-pyrazol-1-yl)-N-{[3-(2-fluorophenyl)-1-methyl-1H-pyrazol-4-yl]methyl}-N-methylethanamine
CID 16189999
1-[3-(1-Methylpyrazol-3-yl)phenyl]-3-phenylurea
CID 2819938
1-[3-(2-fluorophenyl)-1-methyl-1H-pyrazol-4-yl]-N-methyl-N-[4-(1H-pyrazol-1-yl)benzyl]methanamine
CID 16191021
3-methyl-6-(3-{1-[2-(1-pyrrolidinyl)ethyl]-1H-pyrazol-3-yl}phenyl)pyridazine
CID 29149585
4-(3-Methyl-1-phenyl-1h-pyrazol-5-yl)-1,3-diphenyl-1h-pyrazole
CID 76313403
1'-(3-chlorobenzyl)-1,1''-dimethyl-1H,1'H,1''H-4,3':5',4''-terpyrazole
CID 17026020
4-[1-(4-Fluorophenyl)pyrazol-4-yl]-3,5-dimethyl-1-phenylpyrazole
CID 146165854

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole?
The IUPAC name of 5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole (CID 101085773) is 5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole.
What is the SMILES notation for 5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole?
The canonical SMILES for 5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole is Cc1cc(-c2ccccc2)nn1C(n1cccn1)n1nc(-c2ccccc2)cc1C.
What is the InChIKey of 5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole?
The InChIKey is JHUJALPZPVVSBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N6/c1-18-16-22(20-10-5-3-6-11-20)26-29(18)24(28-15-9-14-25-28)30-19(2)17-23(27-30)21-12-7-4-8-13-21/h3-17,24H,1-2H3.
What are the key properties of 5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole?
5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole has a molecular weight of 394.48 g/mol, XLogP of 4.78, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-[(5-methyl-3-phenylpyrazol-1-yl)-pyrazol-1-ylmethyl]-3-phenylpyrazole is sourced from PubChem (CID 101085773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).