4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole

C17H15FN2 — CID 141089646

IUPAC4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole
SMILESCc1ccccc1-n1cc(-c2ccc(F)cc2)c(C)n1
InChIInChI=1S/C17H15FN2/c1-12-5-3-4-6-17(12)20-11-16(13(2)19-20)14-7-9-15(18)10-8-14/h3-11H,1-2H3
InChIKeyCSMRPPLAHQDKRN-UHFFFAOYSA-N
MW266.32 g/mol
LogP4.30
Rot. Bonds2

About 4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole

4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole (PubChem CID 141089646) has the molecular formula C17H15FN2 and a molecular weight of 266.32 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole.

Molecular Properties

Compound Name4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole
PubChem CID141089646
Molecular FormulaC17H15FN2
Molecular Weight266.32 g/mol
Exact Mass266.12
IUPAC Name4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole
SMILESCc1ccccc1-n1cc(-c2ccc(F)cc2)c(C)n1
InChIInChI=1S/C17H15FN2/c1-12-5-3-4-6-17(12)20-11-16(13(2)19-20)14-7-9-15(18)10-8-14/h3-11H,1-2H3
InChIKeyCSMRPPLAHQDKRN-UHFFFAOYSA-N
XLogP4.30
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[3-(4-fluorophenyl)-1-(2-methylphenyl)pyrazol-4-yl]methanol
CID 3793270
4-ethyl-3-(4-fluorophenyl)-1-(2-methylphenyl)pyrazole
CID 141089638
2-[3-methyl-1-(2-methylphenyl)pyrazol-4-yl]ethanol
CID 116817752
3-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide
CID 91675755
[5-(4-fluorophenyl)-1-(2-methylphenyl)pyrazol-3-yl]methanamine
CID 82072215
3-(4-chlorophenyl)-1-(2-methylphenyl)pyrazol-4-amine
CID 83216271
4-[3-methyl-4-(4-methylphenyl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine
CID 118056000
6-[1-(2-methylphenyl)-4-phenylpyrazol-3-yl]-4H-1,4-benzoxazin-3-one
CID 56641349
1-(2-fluorophenyl)-3-(4-fluorophenyl)pyrazole
CID 135065118
3-(4-methoxyphenyl)-1-(2-methylphenyl)pyrazol-4-amine
CID 83204322
2-(2-methylphenyl)-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine
CID 82394167
4-(chloromethyl)-5-(4-fluorophenyl)-1-(2-methylphenyl)triazole
CID 56769743

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole?
The IUPAC name of 4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole (CID 141089646) is 4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole.
What is the SMILES notation for 4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole?
The canonical SMILES for 4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole is Cc1ccccc1-n1cc(-c2ccc(F)cc2)c(C)n1.
What is the InChIKey of 4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole?
The InChIKey is CSMRPPLAHQDKRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2/c1-12-5-3-4-6-17(12)20-11-16(13(2)19-20)14-7-9-15(18)10-8-14/h3-11H,1-2H3.
What are the key properties of 4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole?
4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole has a molecular weight of 266.32 g/mol, XLogP of 4.30, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-3-methyl-1-(2-methylphenyl)pyrazole is sourced from PubChem (CID 141089646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).