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

C20H22N4O — CID 110434229

IUPAC7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline
SMILESCOc1ccc2c(N3CCN(c4ccccn4)CC3)cc(C)nc2c1
InChIInChI=1S/C20H22N4O/c1-15-13-19(17-7-6-16(25-2)14-18(17)22-15)23-9-11-24(12-10-23)20-5-3-4-8-21-20/h3-8,13-14H,9-12H2,1-2H3
InChIKeyXHQXHKCYEOLMRK-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.27
Rot. Bonds3

About 7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline

7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline (PubChem CID 110434229) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline.

Molecular Properties

Compound Name7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline
PubChem CID110434229
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline
SMILESCOc1ccc2c(N3CCN(c4ccccn4)CC3)cc(C)nc2c1
InChIInChI=1S/C20H22N4O/c1-15-13-19(17-7-6-16(25-2)14-18(17)22-15)23-9-11-24(12-10-23)20-5-3-4-8-21-20/h3-8,13-14H,9-12H2,1-2H3
InChIKeyXHQXHKCYEOLMRK-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

7-methoxy-2-methyl-4-[4-(3-methylphenyl)piperazin-1-yl]quinoline
CID 110434228
4-(4-ethylpiperazin-1-yl)-7-methoxy-2-methylquinoline
CID 110434217
7-[(3,5-dimethoxyphenyl)methoxy]-2-methyl-4-pyrrolidin-1-ylquinoline
CID 22641311
2-(4-methoxyphenyl)-3,5-dimethyl-7-(4-pyridin-2-ylpiperazin-1-yl)pyrazolo[1,5-a]pyrimidine
CID 46299322
2-methyl-7-[(2-methyl-3-pyridinyl)methoxy]-4-pyrrolidin-1-ylquinoline;hydrochloride
CID 22641473
(Z)-1-(4-methoxyphenyl)-N-(4-pyridin-2-ylpiperazin-1-yl)methanimine
CID 5413994
(E)-1-(4-methoxyphenyl)-N-(4-pyridin-2-ylpiperazin-1-yl)methanimine
CID 6896964
2-(7-methoxy-4-phenylquinolin-2-yl)sulfanyl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
CID 24677995
2-methyl-7-propan-2-yloxy-4-pyrrolidin-1-ylquinoline
CID 22641342
2-methyl-7-(2-methylpropoxy)-4-pyrrolidin-1-ylquinoline
CID 22641435
2-methyl-7-(pyridin-4-ylmethoxy)-4-pyrrolidin-1-ylquinoline;hydrochloride
CID 22641317
1-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine
CID 133313241

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline?
The IUPAC name of 7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline (CID 110434229) is 7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline.
What is the SMILES notation for 7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline?
The canonical SMILES for 7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline is COc1ccc2c(N3CCN(c4ccccn4)CC3)cc(C)nc2c1.
What is the InChIKey of 7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline?
The InChIKey is XHQXHKCYEOLMRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-15-13-19(17-7-6-16(25-2)14-18(17)22-15)23-9-11-24(12-10-23)20-5-3-4-8-21-20/h3-8,13-14H,9-12H2,1-2H3.
What are the key properties of 7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline?
7-methoxy-2-methyl-4-(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 7-methoxy-2-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)quinoline is sourced from PubChem (CID 110434229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).