6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline

C24H15F2N3 — CID 142291662

IUPAC6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline
SMILESFc1ccc(-n2nc(-c3ccccc3)cc2-c2ccc3cc(F)ccc3n2)cc1
InChIInChI=1S/C24H15F2N3/c25-18-7-10-20(11-8-18)29-24(15-23(28-29)16-4-2-1-3-5-16)22-12-6-17-14-19(26)9-13-21(17)27-22/h1-15H
InChIKeyLJJDWIGSIMHGBA-UHFFFAOYSA-N
MW383.40 g/mol
LogP6.03
Rot. Bonds3

About 6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline

6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline (PubChem CID 142291662) has the molecular formula C24H15F2N3 and a molecular weight of 383.40 g/mol. Its IUPAC name is 6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline.

Molecular Properties

Compound Name6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline
PubChem CID142291662
Molecular FormulaC24H15F2N3
Molecular Weight383.40 g/mol
Exact Mass383.12
IUPAC Name6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline
SMILESFc1ccc(-n2nc(-c3ccccc3)cc2-c2ccc3cc(F)ccc3n2)cc1
InChIInChI=1S/C24H15F2N3/c25-18-7-10-20(11-8-18)29-24(15-23(28-29)16-4-2-1-3-5-16)22-12-6-17-14-19(26)9-13-21(17)27-22/h1-15H
InChIKeyLJJDWIGSIMHGBA-UHFFFAOYSA-N
XLogP6.03
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.40
LogP ≤ 56.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-Aminoacridine
CID 7019
N-Phenyl-9-acridinamine
CID 18757
2,2'-Biquinoline
CID 8412
6-Fluoro-1,2,3,4-tetrahydroacridin-9-amine
CID 10013554
9-Phenylacridine
CID 69041
2-Phenyl-2H-pyrazolo[4,3-c]quinoline
CID 11470612
2-Phenyl-4-pyrrolidin-1-yl-quinoline
CID 3438772
4-(1-Phenyl-1H-pyrazol-4-YL)quinoline
CID 3525815
2-[(E)-2-(2-fluorophenyl)ethenyl]quinoline
CID 5763302
4-(1-Benzyl-3-pyridin-2-yl-1H-pyrazol-4-yl)-quinoline
CID 10361281
8-Fluoro-9-amino-1,2,3,4-tetrahydroacridine
CID 19770286
7-Fluoro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride
CID 164614379

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline?
The IUPAC name of 6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline (CID 142291662) is 6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline.
What is the SMILES notation for 6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline?
The canonical SMILES for 6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline is Fc1ccc(-n2nc(-c3ccccc3)cc2-c2ccc3cc(F)ccc3n2)cc1.
What is the InChIKey of 6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline?
The InChIKey is LJJDWIGSIMHGBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15F2N3/c25-18-7-10-20(11-8-18)29-24(15-23(28-29)16-4-2-1-3-5-16)22-12-6-17-14-19(26)9-13-21(17)27-22/h1-15H.
What are the key properties of 6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline?
6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline has a molecular weight of 383.40 g/mol, XLogP of 6.03, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]quinoline is sourced from PubChem (CID 142291662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).