6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline

C24H23N3O4 — CID 23156578

IUPAC6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline
SMILESCOc1cncc(-c2nc(C)c(C)cc2Oc2ccnc3cc(OC)c(OC)cc23)c1
InChIInChI=1S/C24H23N3O4/c1-14-8-23(24(27-15(14)2)16-9-17(28-3)13-25-12-16)31-20-6-7-26-19-11-22(30-5)21(29-4)10-18(19)20/h6-13H,1-5H3
InChIKeyGLIVWLRCOLSHBK-UHFFFAOYSA-N
MW417.47 g/mol
LogP5.13
Rot. Bonds6

About 6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline

6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline (PubChem CID 23156578) has the molecular formula C24H23N3O4 and a molecular weight of 417.47 g/mol. Its IUPAC name is 6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline.

Molecular Properties

Compound Name6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline
PubChem CID23156578
Molecular FormulaC24H23N3O4
Molecular Weight417.47 g/mol
Exact Mass417.17
IUPAC Name6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline
SMILESCOc1cncc(-c2nc(C)c(C)cc2Oc2ccnc3cc(OC)c(OC)cc23)c1
InChIInChI=1S/C24H23N3O4/c1-14-8-23(24(27-15(14)2)16-9-17(28-3)13-25-12-16)31-20-6-7-26-19-11-22(30-5)21(29-4)10-18(19)20/h6-13H,1-5H3
InChIKeyGLIVWLRCOLSHBK-UHFFFAOYSA-N
XLogP5.13
TPSA75.59 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500417.47
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline with MolForge

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Related Compounds

2-[3-(6,7-dimethoxyquinolin-4-yl)oxy-5,6-dimethyl-2-pyridinyl]-4,5-dimethyl-1,3-thiazole
CID 23156647
2-(aminomethyl)-3-[4-[(5,6-dimethyl-2-pyridin-3-yl-3-pyridinyl)oxy]-6-methoxyquinolin-7-yl]oxypropan-1-ol
CID 143092910
3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-1,6-naphthyridine
CID 23078530
3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-1,7-naphthyridine
CID 23156614
methane;4,6,7-trimethoxyquinoline
CID 157066291
4-(2-fluoro-4-pyrimidin-5-ylphenoxy)-6,7-dimethoxyquinoline
CID 141201268
4-[(5,6-dimethyl-2-pyridin-2-yl-3-pyridinyl)oxy]-6-methylquinoline
CID 23156612
[2-(6,7-dimethoxyquinolin-4-yl)oxy-4,5-dimethylphenyl]-phenylmethanone
CID 23156626
6,7-dimethoxy-4-quinolin-3-yloxyquinoline
CID 23078609
2-(6,7-dimethoxyquinolin-4-yl)oxy-4-methoxybenzaldehyde
CID 23078274
4-[4,5-dimethyl-2-(1-nitrosoethyl)phenoxy]-6,7-dimethoxyquinoline
CID 91595077
4-(6,7-dimethoxyquinolin-4-yl)oxyaniline;dihydrochloride
CID 118991674

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline?
The IUPAC name of 6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline (CID 23156578) is 6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline.
What is the SMILES notation for 6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline?
The canonical SMILES for 6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline is COc1cncc(-c2nc(C)c(C)cc2Oc2ccnc3cc(OC)c(OC)cc23)c1.
What is the InChIKey of 6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline?
The InChIKey is GLIVWLRCOLSHBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O4/c1-14-8-23(24(27-15(14)2)16-9-17(28-3)13-25-12-16)31-20-6-7-26-19-11-22(30-5)21(29-4)10-18(19)20/h6-13H,1-5H3.
What are the key properties of 6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline?
6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline has a molecular weight of 417.47 g/mol, XLogP of 5.13, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxy-4-[[2-(5-methoxy-3-pyridinyl)-5,6-dimethyl-3-pyridinyl]oxy]quinoline is sourced from PubChem (CID 23156578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).