8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline

C21H17N3O — CID 21024858

IUPAC8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline
SMILESCOc1c(-c2ccccn2)cc(-c2ccccn2)c2ccc(C)nc12
InChIInChI=1S/C21H17N3O/c1-14-9-10-15-16(18-7-3-5-11-22-18)13-17(19-8-4-6-12-23-19)21(25-2)20(15)24-14/h3-13H,1-2H3
InChIKeyPKBJSYRZFREFRV-UHFFFAOYSA-N
MW327.39 g/mol
LogP4.68
Rot. Bonds3

About 8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline

8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline (PubChem CID 21024858) has the molecular formula C21H17N3O and a molecular weight of 327.39 g/mol. Its IUPAC name is 8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline.

Molecular Properties

Compound Name8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline
PubChem CID21024858
Molecular FormulaC21H17N3O
Molecular Weight327.39 g/mol
Exact Mass327.14
IUPAC Name8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline
SMILESCOc1c(-c2ccccn2)cc(-c2ccccn2)c2ccc(C)nc12
InChIInChI=1S/C21H17N3O/c1-14-9-10-15-16(18-7-3-5-11-22-18)13-17(19-8-4-6-12-23-19)21(25-2)20(15)24-14/h3-13H,1-2H3
InChIKeyPKBJSYRZFREFRV-UHFFFAOYSA-N
XLogP4.68
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3,6-dimethylquinoxalino[2,3-f][1,10]phenanthroline;bis(2-pyridin-2-ylpyridine);ruthenium
CID 140706892
2-(2,6-dimethoxy-4-pyridin-2-ylnaphthalen-1-yl)pyridine
CID 169050230
2-(2,3,4-trimethoxy-5-propylphenyl)pyridine
CID 173295109
4-[8-methoxy-2-(methylamino)-5-pyridin-2-ylquinazolin-7-yl]benzoic acid
CID 23157875
2-(2,5-dimethyl-4-pyridin-2-ylphenyl)pyridine
CID 118652406
2-methoxy-3-pyridin-2-ylaniline
CID 171626476
2,6-dimethoxy-3-pyridin-2-ylpyridine
CID 67608577
2-(3,4-dimethoxy-5-pyridin-2-ylphenyl)ethanamine
CID 39226519
2-(2-ethynyl-5-methoxyphenyl)pyridine
CID 87144328
2-(3-methylanthracen-1-yl)pyridine
CID 169060480
2-methoxy-3-pyridin-2-ylpyridine
CID 90702321
2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine
CID 102052636

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline?
The IUPAC name of 8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline (CID 21024858) is 8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline.
What is the SMILES notation for 8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline?
The canonical SMILES for 8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline is COc1c(-c2ccccn2)cc(-c2ccccn2)c2ccc(C)nc12.
What is the InChIKey of 8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline?
The InChIKey is PKBJSYRZFREFRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O/c1-14-9-10-15-16(18-7-3-5-11-22-18)13-17(19-8-4-6-12-23-19)21(25-2)20(15)24-14/h3-13H,1-2H3.
What are the key properties of 8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline?
8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline has a molecular weight of 327.39 g/mol, XLogP of 4.68, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-2-methyl-5,7-dipyridin-2-ylquinoline is sourced from PubChem (CID 21024858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).