6-methoxy-4-(4-methylpiperazin-2-yl)quinoline

C15H19N3O — CID 82665396

IUPAC6-methoxy-4-(4-methylpiperazin-2-yl)quinoline
SMILESCOc1ccc2nccc(C3CN(C)CCN3)c2c1
InChIInChI=1S/C15H19N3O/c1-18-8-7-17-15(10-18)12-5-6-16-14-4-3-11(19-2)9-13(12)14/h3-6,9,15,17H,7-8,10H2,1-2H3
InChIKeyVOAUFEHGUZADIZ-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.82
Rot. Bonds2

About 6-methoxy-4-(4-methylpiperazin-2-yl)quinoline

6-methoxy-4-(4-methylpiperazin-2-yl)quinoline (PubChem CID 82665396) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 6-methoxy-4-(4-methylpiperazin-2-yl)quinoline.

Molecular Properties

Compound Name6-methoxy-4-(4-methylpiperazin-2-yl)quinoline
PubChem CID82665396
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name6-methoxy-4-(4-methylpiperazin-2-yl)quinoline
SMILESCOc1ccc2nccc(C3CN(C)CCN3)c2c1
InChIInChI=1S/C15H19N3O/c1-18-8-7-17-15(10-18)12-5-6-16-14-4-3-11(19-2)9-13(12)14/h3-6,9,15,17H,7-8,10H2,1-2H3
InChIKeyVOAUFEHGUZADIZ-UHFFFAOYSA-N
XLogP1.82
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methoxy-4-(1-methylpyrrolidin-3-yl)oxyquinoline
CID 126953937
5-ethoxy-3-(4-methylpiperazin-2-yl)-1H-indole
CID 84637851
3-(2-methoxy-5-methylphenyl)-1-methylpiperazine
CID 82114400
(3S)-1-(6-methoxyquinolin-4-yl)-N-methylpyrrolidin-3-amine
CID 66954288
1-[1-[1-(6-methoxyquinolin-4-yl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one
CID 126945708
(5R)-5-(6-methoxyquinolin-4-yl)-3-[3-(methylamino)propyl]-1,3-oxazolidin-2-one
CID 68839809
2,6-dimethoxy-4-[3-(3-methoxyphenyl)piperazin-1-yl]quinazoline
CID 141195742
2-(4-methylpiperazin-2-yl)phenol
CID 83445266
1-azabicyclo[2.2.1]heptan-2-yl-(6-methoxyquinolin-4-yl)methanol
CID 132545018
(3R,7S,8R,10S,15R,19S,20R,22S)-7,19-bis(6-methoxyquinolin-4-yl)-6,18-dioxa-1,13-diazapentacyclo[18.4.0.03,22.08,13.010,15]tetracosane-5,17-dione
CID 10556451
2-[5-(hydroxymethyl)-1,4-diazocan-1-yl]-1-(6-methoxyquinolin-4-yl)ethanol
CID 142884528
7-methoxy-N-[(4-methylmorpholin-2-yl)methyl]isoquinolin-1-amine
CID 106539026

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-(4-methylpiperazin-2-yl)quinoline?
The IUPAC name of 6-methoxy-4-(4-methylpiperazin-2-yl)quinoline (CID 82665396) is 6-methoxy-4-(4-methylpiperazin-2-yl)quinoline.
What is the SMILES notation for 6-methoxy-4-(4-methylpiperazin-2-yl)quinoline?
The canonical SMILES for 6-methoxy-4-(4-methylpiperazin-2-yl)quinoline is COc1ccc2nccc(C3CN(C)CCN3)c2c1.
What is the InChIKey of 6-methoxy-4-(4-methylpiperazin-2-yl)quinoline?
The InChIKey is VOAUFEHGUZADIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-18-8-7-17-15(10-18)12-5-6-16-14-4-3-11(19-2)9-13(12)14/h3-6,9,15,17H,7-8,10H2,1-2H3.
What are the key properties of 6-methoxy-4-(4-methylpiperazin-2-yl)quinoline?
6-methoxy-4-(4-methylpiperazin-2-yl)quinoline has a molecular weight of 257.34 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-(4-methylpiperazin-2-yl)quinoline is sourced from PubChem (CID 82665396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).