8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline

C22H26N4O2 — CID 171908410

IUPAC8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline
SMILESCOc1cncc(-c2cc(C)c3cc(N4CCN(C)CC4)cc(OC)c3n2)c1
InChIInChI=1S/C22H26N4O2/c1-15-9-20(16-10-18(27-3)14-23-13-16)24-22-19(15)11-17(12-21(22)28-4)26-7-5-25(2)6-8-26/h9-14H,5-8H2,1-4H3
InChIKeyREUCVHXJFXUDPM-UHFFFAOYSA-N
MW378.48 g/mol
LogP3.37
Rot. Bonds4

About 8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline

8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline (PubChem CID 171908410) has the molecular formula C22H26N4O2 and a molecular weight of 378.48 g/mol. Its IUPAC name is 8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline.

Molecular Properties

Compound Name8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline
PubChem CID171908410
Molecular FormulaC22H26N4O2
Molecular Weight378.48 g/mol
Exact Mass378.21
IUPAC Name8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline
SMILESCOc1cncc(-c2cc(C)c3cc(N4CCN(C)CC4)cc(OC)c3n2)c1
InChIInChI=1S/C22H26N4O2/c1-15-9-20(16-10-18(27-3)14-23-13-16)24-22-19(15)11-17(12-21(22)28-4)26-7-5-25(2)6-8-26/h9-14H,5-8H2,1-4H3
InChIKeyREUCVHXJFXUDPM-UHFFFAOYSA-N
XLogP3.37
TPSA50.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.48
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

8-methoxy-2-(6-methoxy-2-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline
CID 171909719
8-methoxy-4-methyl-6-(4-methylpiperazin-1-yl)-2-(2-propan-2-ylpyrimidin-4-yl)quinoline
CID 169410635
4-[5-(4-methoxyphenyl)-3-pyridinyl]-2-methyl-6-(4-methylpiperazin-1-yl)pyrimidine
CID 3653747
3-(5-methoxy-3-pyridinyl)-1-methyl-5-(4-methylpiperazin-1-yl)pyrrolo[3,2-b]pyridine
CID 123323852
7-(6,8-dimethoxy-4-methylquinolin-2-yl)-9-methoxy-2,3,4,5-tetrahydro-1,4-benzoxazepine
CID 118760142
[2-methoxy-4-(4-methylpiperazin-1-yl)phenyl]boronic acid
CID 124926588
formic acid;2-methoxy-4-[4-methyl-6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]phenol
CID 166598221
2-[4-(5-methoxy-3-pyridinyl)naphthalen-1-yl]oxy-1-(4-methylpiperazin-1-yl)ethanone
CID 172671480
1-(3,4-dimethoxyphenyl)-4-methylpiperazine
CID 21363782
8-methoxy-4-methyl-2-(4-methyl-1,4-diazepan-1-yl)quinoline
CID 6456448
4-methyl-2-[4-(4-methylpiperazin-1-yl)phenyl]quinoline;hydrochloride
CID 42887250
3-methoxy-4-[4-methyl-6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]phenol
CID 165419779

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline?
The IUPAC name of 8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline (CID 171908410) is 8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline.
What is the SMILES notation for 8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline?
The canonical SMILES for 8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline is COc1cncc(-c2cc(C)c3cc(N4CCN(C)CC4)cc(OC)c3n2)c1.
What is the InChIKey of 8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline?
The InChIKey is REUCVHXJFXUDPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O2/c1-15-9-20(16-10-18(27-3)14-23-13-16)24-22-19(15)11-17(12-21(22)28-4)26-7-5-25(2)6-8-26/h9-14H,5-8H2,1-4H3.
What are the key properties of 8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline?
8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline has a molecular weight of 378.48 g/mol, XLogP of 3.37, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-2-(5-methoxy-3-pyridinyl)-4-methyl-6-(4-methylpiperazin-1-yl)quinoline is sourced from PubChem (CID 171908410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).