6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline

C21H19N5 — CID 126894311

IUPAC6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline
SMILESc1ccc2c(N3CCN(c4ccc5ncncc5c4)CC3)ccnc2c1
InChIInChI=1S/C21H19N5/c1-2-4-20-18(3-1)21(7-8-23-20)26-11-9-25(10-12-26)17-5-6-19-16(13-17)14-22-15-24-19/h1-8,13-15H,9-12H2
InChIKeyCJLZBFINZHZSSH-UHFFFAOYSA-N
MW341.42 g/mol
LogP3.50
Rot. Bonds2

About 6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline

6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline (PubChem CID 126894311) has the molecular formula C21H19N5 and a molecular weight of 341.42 g/mol. Its IUPAC name is 6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline.

Molecular Properties

Compound Name6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline
PubChem CID126894311
Molecular FormulaC21H19N5
Molecular Weight341.42 g/mol
Exact Mass341.16
IUPAC Name6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline
SMILESc1ccc2c(N3CCN(c4ccc5ncncc5c4)CC3)ccnc2c1
InChIInChI=1S/C21H19N5/c1-2-4-20-18(3-1)21(7-8-23-20)26-11-9-25(10-12-26)17-5-6-19-16(13-17)14-22-15-24-19/h1-8,13-15H,9-12H2
InChIKeyCJLZBFINZHZSSH-UHFFFAOYSA-N
XLogP3.50
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.42
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-[4-(6-methoxyquinolin-4-yl)piperazin-1-yl]quinazoline
CID 126894256
6-[4-(2-cyclobutylpyrimidin-4-yl)piperazin-1-yl]quinazoline
CID 126894515
1,1,1-trifluoro-3-(4-quinazolin-6-ylpiperazin-1-yl)propan-2-ol
CID 126894549
1-quinolin-4-ylpiperidin-4-one
CID 22000285
6-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]quinazoline
CID 126894296
N-[5-(4-quinolin-4-ylpiperazin-1-yl)-2-pyridinyl]cyclopropanecarboxamide
CID 163357165
6-[4-[(2-cyclobutylpyrimidin-4-yl)methyl]piperazin-1-yl]quinazoline
CID 126894373
2-(4-quinolin-4-ylpiperazin-1-yl)ethanamine
CID 61340442
1-quinolin-4-ylpiperidine-4-carbaldehyde
CID 62663267
6-[4-(7H-purin-6-yl)piperazin-1-yl]quinazoline
CID 126894249
(4-quinazolin-6-ylpiperazin-1-yl)-(1H-1,2,4-triazol-5-yl)methanone
CID 126894181
6-[4-(oxolan-3-ylmethyl)piperazin-1-yl]quinazoline
CID 126894285

Frequently Asked Questions

What is the IUPAC name of 6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline?
The IUPAC name of 6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline (CID 126894311) is 6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline.
What is the SMILES notation for 6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline?
The canonical SMILES for 6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline is c1ccc2c(N3CCN(c4ccc5ncncc5c4)CC3)ccnc2c1.
What is the InChIKey of 6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline?
The InChIKey is CJLZBFINZHZSSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5/c1-2-4-20-18(3-1)21(7-8-23-20)26-11-9-25(10-12-26)17-5-6-19-16(13-17)14-22-15-24-19/h1-8,13-15H,9-12H2.
What are the key properties of 6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline?
6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline has a molecular weight of 341.42 g/mol, XLogP of 3.50, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-quinolin-4-ylpiperazin-1-yl)quinazoline is sourced from PubChem (CID 126894311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).