2-(1-quinolin-2-ylpiperazin-2-yl)quinoline

C22H20N4 — CID 22414728

IUPAC2-(1-quinolin-2-ylpiperazin-2-yl)quinoline
SMILESc1ccc2nc(C3CNCCN3c3ccc4ccccc4n3)ccc2c1
InChIInChI=1S/C22H20N4/c1-3-7-18-16(5-1)9-11-20(24-18)21-15-23-13-14-26(21)22-12-10-17-6-2-4-8-19(17)25-22/h1-12,21,23H,13-15H2
InChIKeyAUQZJTGRPQCAGZ-UHFFFAOYSA-N
MW340.43 g/mol
LogP3.93
Rot. Bonds2

About 2-(1-quinolin-2-ylpiperazin-2-yl)quinoline

2-(1-quinolin-2-ylpiperazin-2-yl)quinoline (PubChem CID 22414728) has the molecular formula C22H20N4 and a molecular weight of 340.43 g/mol. Its IUPAC name is 2-(1-quinolin-2-ylpiperazin-2-yl)quinoline.

Molecular Properties

Compound Name2-(1-quinolin-2-ylpiperazin-2-yl)quinoline
PubChem CID22414728
Molecular FormulaC22H20N4
Molecular Weight340.43 g/mol
Exact Mass340.17
IUPAC Name2-(1-quinolin-2-ylpiperazin-2-yl)quinoline
SMILESc1ccc2nc(C3CNCCN3c3ccc4ccccc4n3)ccc2c1
InChIInChI=1S/C22H20N4/c1-3-7-18-16(5-1)9-11-20(24-18)21-15-23-13-14-26(21)22-12-10-17-6-2-4-8-19(17)25-22/h1-12,21,23H,13-15H2
InChIKeyAUQZJTGRPQCAGZ-UHFFFAOYSA-N
XLogP3.93
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-quinolin-2-ylpiperazin-2-yl)quinoline?
The IUPAC name of 2-(1-quinolin-2-ylpiperazin-2-yl)quinoline (CID 22414728) is 2-(1-quinolin-2-ylpiperazin-2-yl)quinoline.
What is the SMILES notation for 2-(1-quinolin-2-ylpiperazin-2-yl)quinoline?
The canonical SMILES for 2-(1-quinolin-2-ylpiperazin-2-yl)quinoline is c1ccc2nc(C3CNCCN3c3ccc4ccccc4n3)ccc2c1.
What is the InChIKey of 2-(1-quinolin-2-ylpiperazin-2-yl)quinoline?
The InChIKey is AUQZJTGRPQCAGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4/c1-3-7-18-16(5-1)9-11-20(24-18)21-15-23-13-14-26(21)22-12-10-17-6-2-4-8-19(17)25-22/h1-12,21,23H,13-15H2.
What are the key properties of 2-(1-quinolin-2-ylpiperazin-2-yl)quinoline?
2-(1-quinolin-2-ylpiperazin-2-yl)quinoline has a molecular weight of 340.43 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-quinolin-2-ylpiperazin-2-yl)quinoline is sourced from PubChem (CID 22414728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).