2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline

C23H19N3 — CID 141304902

IUPAC2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline
SMILESCn1cc2c(n1)-c1cc(-c3ccccc3)c(-c3ccccc3)nc1CC2
InChIInChI=1S/C23H19N3/c1-26-15-18-12-13-21-20(23(18)25-26)14-19(16-8-4-2-5-9-16)22(24-21)17-10-6-3-7-11-17/h2-11,14-15H,12-13H2,1H3
InChIKeyXCNMSCCJMOBYPE-UHFFFAOYSA-N
MW337.43 g/mol
LogP4.91
Rot. Bonds2

About 2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline

2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline (PubChem CID 141304902) has the molecular formula C23H19N3 and a molecular weight of 337.43 g/mol. Its IUPAC name is 2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline.

Molecular Properties

Compound Name2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline
PubChem CID141304902
Molecular FormulaC23H19N3
Molecular Weight337.43 g/mol
Exact Mass337.16
IUPAC Name2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline
SMILESCn1cc2c(n1)-c1cc(-c3ccccc3)c(-c3ccccc3)nc1CC2
InChIInChI=1S/C23H19N3/c1-26-15-18-12-13-21-20(23(18)25-26)14-19(16-8-4-2-5-9-16)22(24-21)17-10-6-3-7-11-17/h2-11,14-15H,12-13H2,1H3
InChIKeyXCNMSCCJMOBYPE-UHFFFAOYSA-N
XLogP4.91
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline?
The IUPAC name of 2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline (CID 141304902) is 2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline.
What is the SMILES notation for 2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline?
The canonical SMILES for 2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline is Cn1cc2c(n1)-c1cc(-c3ccccc3)c(-c3ccccc3)nc1CC2.
What is the InChIKey of 2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline?
The InChIKey is XCNMSCCJMOBYPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3/c1-26-15-18-12-13-21-20(23(18)25-26)14-19(16-8-4-2-5-9-16)22(24-21)17-10-6-3-7-11-17/h2-11,14-15H,12-13H2,1H3.
What are the key properties of 2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline?
2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline has a molecular weight of 337.43 g/mol, XLogP of 4.91, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7,8-diphenyl-4,5-dihydropyrazolo[3,4-f]quinoline is sourced from PubChem (CID 141304902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).