6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride

C20H26Cl4N4O — CID 171686344

IUPAC6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride
SMILESCOc1ccc2nc(C)cc(-c3ccnc(N4CCNCC4)c3)c2c1.Cl.Cl.Cl.Cl
InChIInChI=1S/C20H22N4O.4ClH/c1-14-11-17(18-13-16(25-2)3-4-19(18)23-14)15-5-6-22-20(12-15)24-9-7-21-8-10-24;;;;/h3-6,11-13,21H,7-10H2,1-2H3;4*1H
InChIKeyZOLDKRFPLIKTJS-UHFFFAOYSA-N
MW480.27 g/mol
LogP4.71
Rot. Bonds3

About 6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride

6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride (PubChem CID 171686344) has the molecular formula C20H26Cl4N4O and a molecular weight of 480.27 g/mol. Its IUPAC name is 6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride.

Molecular Properties

Compound Name6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride
PubChem CID171686344
Molecular FormulaC20H26Cl4N4O
Molecular Weight480.27 g/mol
Exact Mass478.09
IUPAC Name6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride
SMILESCOc1ccc2nc(C)cc(-c3ccnc(N4CCNCC4)c3)c2c1.Cl.Cl.Cl.Cl
InChIInChI=1S/C20H22N4O.4ClH/c1-14-11-17(18-13-16(25-2)3-4-19(18)23-14)15-5-6-22-20(12-15)24-9-7-21-8-10-24;;;;/h3-6,11-13,21H,7-10H2,1-2H3;4*1H
InChIKeyZOLDKRFPLIKTJS-UHFFFAOYSA-N
XLogP4.71
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500480.27
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6,7-dimethoxy-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride
CID 171686356
6-methoxy-2-methyl-4-(4-methylphenyl)quinoline
CID 101221850
6-methoxy-2-methyl-4-phenylquinoline
CID 12787220
4-(2-piperazin-1-yl-4-pyridinyl)-2-(trifluoromethyl)quinoline;tetrahydrochloride
CID 171686350
7-methoxy-4-methyl-2-piperazin-1-ylquinoline;hydrochloride
CID 121237212
7-methoxy-1-piperazin-1-ylisoquinoline
CID 23155836
3-chloro-6-methoxy-2-methyl-4-piperazin-1-ylquinoline
CID 121236492
6-methoxy-4-piperazin-1-yl-2-propylquinoline
CID 121237076
1-[4-(1H-pyrazol-5-yl)-2-pyridinyl]piperazine
CID 105486911
7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline
CID 110434229
3-bromo-6-methoxy-4-piperazin-1-ylquinoline
CID 121236333
4-(2-piperazin-1-yl-4-pyridinyl)-8-(trifluoromethyl)quinoline;tetrahydrochloride
CID 171686354

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride?
The IUPAC name of 6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride (CID 171686344) is 6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride.
What is the SMILES notation for 6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride?
The canonical SMILES for 6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride is COc1ccc2nc(C)cc(-c3ccnc(N4CCNCC4)c3)c2c1.Cl.Cl.Cl.Cl.
What is the InChIKey of 6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride?
The InChIKey is ZOLDKRFPLIKTJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O.4ClH/c1-14-11-17(18-13-16(25-2)3-4-19(18)23-14)15-5-6-22-20(12-15)24-9-7-21-8-10-24;;;;/h3-6,11-13,21H,7-10H2,1-2H3;4*1H.
What are the key properties of 6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride?
6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride has a molecular weight of 480.27 g/mol, XLogP of 4.71, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-methyl-4-(2-piperazin-1-yl-4-pyridinyl)quinoline;tetrahydrochloride is sourced from PubChem (CID 171686344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).