8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline

C20H22N4O — CID 23931520

IUPAC8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline
SMILESCOc1cccc2c(C)cc(N3CCN(c4ccccn4)CC3)nc12
InChIInChI=1S/C20H22N4O/c1-15-14-19(22-20-16(15)6-5-7-17(20)25-2)24-12-10-23(11-13-24)18-8-3-4-9-21-18/h3-9,14H,10-13H2,1-2H3
InChIKeyAFTYKARYWCTTDT-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.27
Rot. Bonds3

About 8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline

8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline (PubChem CID 23931520) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline.

Molecular Properties

Compound Name8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline
PubChem CID23931520
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline
SMILESCOc1cccc2c(C)cc(N3CCN(c4ccccn4)CC3)nc12
InChIInChI=1S/C20H22N4O/c1-15-14-19(22-20-16(15)6-5-7-17(20)25-2)24-12-10-23(11-13-24)18-8-3-4-9-21-18/h3-9,14H,10-13H2,1-2H3
InChIKeyAFTYKARYWCTTDT-UHFFFAOYSA-N
XLogP3.27
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(4-fluorophenyl)piperazin-1-yl]-8-methoxy-4-methylquinoline
CID 1365048
8-methoxy-4-methyl-2-(4-methyl-1,4-diazepan-1-yl)quinoline
CID 6456448
8-methoxy-4-methyl-2-piperazin-1-ylquinoline;oxalic acid
CID 75464988
(2S,6S)-4-(8-methoxy-4-methylquinolin-2-yl)-2,6-dimethylmorpholine
CID 27271146
(2R,6R)-4-(8-methoxy-4-methylquinolin-2-yl)-2,6-dimethylmorpholine
CID 27271148
(2-iodophenyl)-[4-(8-methoxy-4-methylquinolin-2-yl)piperazin-1-yl]methanone
CID 108764373
3-bromo-1-[4-(8-methoxy-4-methylquinolin-2-yl)piperazin-1-yl]propan-1-one
CID 108741927
(4-chlorophenyl)-[4-(8-methoxy-4-methylquinolin-2-yl)piperazin-1-yl]methanone
CID 108764370
4-(2,6-dimethylphenoxy)-1-[4-(8-methoxy-4-methylquinolin-2-yl)piperazin-1-yl]butan-1-one
CID 108764444
N-cyclohexyl-4-(8-methoxy-4-methylquinolin-2-yl)piperazine-1-carbothioamide
CID 108783044
1-[4-(4,8-dimethylquinolin-2-yl)piperazin-1-yl]-2-(2-methoxyphenoxy)ethanone
CID 108731191
7-methoxy-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
CID 90268021

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline?
The IUPAC name of 8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline (CID 23931520) is 8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline.
What is the SMILES notation for 8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline?
The canonical SMILES for 8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline is COc1cccc2c(C)cc(N3CCN(c4ccccn4)CC3)nc12.
What is the InChIKey of 8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline?
The InChIKey is AFTYKARYWCTTDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-15-14-19(22-20-16(15)6-5-7-17(20)25-2)24-12-10-23(11-13-24)18-8-3-4-9-21-18/h3-9,14H,10-13H2,1-2H3.
What are the key properties of 8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline?
8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline has a molecular weight of 334.42 g/mol, XLogP of 3.27, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline is sourced from PubChem (CID 23931520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).