4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole

C25H24N2O2 — CID 19586817

IUPAC4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole
SMILESCCc1c(-c2ccc(OC)cc2)nn(-c2ccccc2)c1-c1ccc(OC)cc1
InChIInChI=1S/C25H24N2O2/c1-4-23-24(18-10-14-21(28-2)15-11-18)26-27(20-8-6-5-7-9-20)25(23)19-12-16-22(29-3)17-13-19/h5-17H,4H2,1-3H3
InChIKeyQSTKXPVLPHSVJA-UHFFFAOYSA-N
MW384.48 g/mol
LogP5.79
Rot. Bonds6

About 4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole

4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole (PubChem CID 19586817) has the molecular formula C25H24N2O2 and a molecular weight of 384.48 g/mol. Its IUPAC name is 4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole.

Molecular Properties

Compound Name4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole
PubChem CID19586817
Molecular FormulaC25H24N2O2
Molecular Weight384.48 g/mol
Exact Mass384.18
IUPAC Name4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole
SMILESCCc1c(-c2ccc(OC)cc2)nn(-c2ccccc2)c1-c1ccc(OC)cc1
InChIInChI=1S/C25H24N2O2/c1-4-23-24(18-10-14-21(28-2)15-11-18)26-27(20-8-6-5-7-9-20)25(23)19-12-16-22(29-3)17-13-19/h5-17H,4H2,1-3H3
InChIKeyQSTKXPVLPHSVJA-UHFFFAOYSA-N
XLogP5.79
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.48
LogP ≤ 55.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-1-(4-methoxyphenyl)-3,5-diphenylpyrazole
CID 10808049
2-[4-ethyl-3,5-bis(4-methoxyphenyl)pyrazol-1-yl]-5-methyl-4-phenyl-1,3-thiazole
CID 19586800
1,3,5-tris(4-methoxyphenyl)-4-(2-methylpropyl)pyrazole
CID 10527185
1-(4-methoxyphenyl)-3,5-bis(4-methylphenyl)-4-phenylpyrazole
CID 56589754
4-[3-(4-hydroxyphenyl)-1-phenyl-4-propylpyrazol-5-yl]phenol
CID 135494350
(4-methoxyphenyl)-(1,3,5-triphenylpyrazol-4-yl)methanone
CID 10884492
4-methoxy-1,3,5-triphenylpyrazole
CID 21489465
4-(4-chlorophenyl)-2-[4-ethyl-3,5-bis(4-methoxyphenyl)pyrazol-1-yl]-1,3-thiazole
CID 19586745
4-ethyl-3-(4-methoxyphenyl)-1-phenylpyrazole
CID 67740433
1-cyclopentyl-4-ethyl-3,5-bis(4-methoxyphenyl)pyrazole
CID 19587444
4-ethyl-3,5-bis(4-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]pyrazole
CID 19586315
4-ethyl-3-(4-methylphenyl)-1-phenylpyrazol-5-amine
CID 43670879

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole?
The IUPAC name of 4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole (CID 19586817) is 4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole.
What is the SMILES notation for 4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole?
The canonical SMILES for 4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole is CCc1c(-c2ccc(OC)cc2)nn(-c2ccccc2)c1-c1ccc(OC)cc1.
What is the InChIKey of 4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole?
The InChIKey is QSTKXPVLPHSVJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O2/c1-4-23-24(18-10-14-21(28-2)15-11-18)26-27(20-8-6-5-7-9-20)25(23)19-12-16-22(29-3)17-13-19/h5-17H,4H2,1-3H3.
What are the key properties of 4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole?
4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole has a molecular weight of 384.48 g/mol, XLogP of 5.79, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole is sourced from PubChem (CID 19586817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).