1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole

C19H19FN2 — CID 142867371

IUPAC1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole
SMILESCCCc1nn(-c2ccc(F)cc2)cc1-c1ccc(C)cc1
InChIInChI=1S/C19H19FN2/c1-3-4-19-18(15-7-5-14(2)6-8-15)13-22(21-19)17-11-9-16(20)10-12-17/h5-13H,3-4H2,1-2H3
InChIKeyNQPKPAJGIQMLNM-UHFFFAOYSA-N
MW294.37 g/mol
LogP4.94
Rot. Bonds4

About 1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole

1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole (PubChem CID 142867371) has the molecular formula C19H19FN2 and a molecular weight of 294.37 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole.

Molecular Properties

Compound Name1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole
PubChem CID142867371
Molecular FormulaC19H19FN2
Molecular Weight294.37 g/mol
Exact Mass294.15
IUPAC Name1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole
SMILESCCCc1nn(-c2ccc(F)cc2)cc1-c1ccc(C)cc1
InChIInChI=1S/C19H19FN2/c1-3-4-19-18(15-7-5-14(2)6-8-15)13-22(21-19)17-11-9-16(20)10-12-17/h5-13H,3-4H2,1-2H3
InChIKeyNQPKPAJGIQMLNM-UHFFFAOYSA-N
XLogP4.94
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluorophenyl)-3-(4-methylphenyl)pyrazol-4-ol
CID 99938045
[1-(4-fluorophenyl)-3-(4-methylphenyl)pyrazol-4-yl]methanamine
CID 28910918
sodium 2-[4-(4-chlorophenyl)-1-(4-fluorophenyl)pyrazol-3-yl]acetate
CID 23674741
3-[3-(4-fluorophenyl)-1-(4-methylphenyl)pyrazol-4-yl]propanoic acid
CID 91871983
1-(4-fluorophenyl)-3-(4-methylphenyl)pyrazole-4-carbaldehyde
CID 1051907
3-(chloromethyl)-4-(4-fluorophenyl)-1-methylpyrazole
CID 154672779
1-[[3-(4-fluorophenyl)-1-(4-methylphenyl)pyrazol-4-yl]methyl]piperidin-4-ol
CID 25486900
5-chloro-4-(chloromethyl)-1-(4-fluorophenyl)-3-propylpyrazole
CID 43333742
[4-(4-fluorophenyl)-1-methylpyrazol-3-yl]methanol
CID 69207008
2-[4-chloro-1-(4-fluorophenyl)pyrazol-3-yl]ethanamine
CID 83898598
ethyl 1-(3,5-difluorophenyl)-4-(4-fluorophenyl)pyrazole-3-carboxylate
CID 175491386
methyl 2-[[1-(4-fluorophenyl)-3-(4-methylphenyl)pyrazole-4-carbonyl]amino]acetate
CID 27682175

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole?
The IUPAC name of 1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole (CID 142867371) is 1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole.
What is the SMILES notation for 1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole?
The canonical SMILES for 1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole is CCCc1nn(-c2ccc(F)cc2)cc1-c1ccc(C)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole?
The InChIKey is NQPKPAJGIQMLNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2/c1-3-4-19-18(15-7-5-14(2)6-8-15)13-22(21-19)17-11-9-16(20)10-12-17/h5-13H,3-4H2,1-2H3.
What are the key properties of 1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole?
1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole has a molecular weight of 294.37 g/mol, XLogP of 4.94, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-4-(4-methylphenyl)-3-propylpyrazole is sourced from PubChem (CID 142867371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).