2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline

C23H17N3O — CID 147507303

IUPAC2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline
SMILESCOc1cncc(-c2ccc3nc(C4=Nc5ccccc5C4)ccc3c2)c1
InChIInChI=1S/C23H17N3O/c1-27-19-11-18(13-24-14-19)15-6-8-21-17(10-15)7-9-22(25-21)23-12-16-4-2-3-5-20(16)26-23/h2-11,13-14H,12H2,1H3
InChIKeyFIPAOKPSVWSERP-UHFFFAOYSA-N
MW351.41 g/mol
LogP4.98
Rot. Bonds3

About 2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline

2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline (PubChem CID 147507303) has the molecular formula C23H17N3O and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline.

Molecular Properties

Compound Name2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline
PubChem CID147507303
Molecular FormulaC23H17N3O
Molecular Weight351.41 g/mol
Exact Mass351.14
IUPAC Name2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline
SMILESCOc1cncc(-c2ccc3nc(C4=Nc5ccccc5C4)ccc3c2)c1
InChIInChI=1S/C23H17N3O/c1-27-19-11-18(13-24-14-19)15-6-8-21-17(10-15)7-9-22(25-21)23-12-16-4-2-3-5-20(16)26-23/h2-11,13-14H,12H2,1H3
InChIKeyFIPAOKPSVWSERP-UHFFFAOYSA-N
XLogP4.98
TPSA47.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-(5-methoxy-3-pyridinyl)-2-(3H-pyrrol-2-yl)-1,3-benzoxazole
CID 147844868
5-(5-methoxy-3-pyridinyl)-2-pyridin-2-yl-1H-indole
CID 146451960
6-(5-methoxy-3-pyridinyl)-1,3-benzoxazole-2-carbaldehyde
CID 122447531
4-(6-methoxyquinolin-2-yl)-N-methylaniline
CID 46931568
benzene;ethane;2-phenyl-3H-indole
CID 91573421
6-(5-methoxy-3-pyridinyl)-1,3-benzothiazole-2-carbaldehyde
CID 122447509
2-[5-(3,5-dipyridin-3-ylphenyl)-2-pyridin-3-ylphenyl]-3H-indole
CID 70870233
5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine
CID 11588162
4-chloro-6-(5-methoxy-3-pyridinyl)-2-pyridin-3-ylquinazoline
CID 89417196
(E)-2-[6-(5-methoxy-3-pyridinyl)-1,3-benzoxazol-2-yl]-N-methylethenamine
CID 122495018
6-(5-methoxy-3-pyridinyl)pyridin-2-amine
CID 39834222
6-bromo-2-(3-methoxyphenyl)quinoline
CID 53443478

Frequently Asked Questions

What is the IUPAC name of 2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline?
The IUPAC name of 2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline (CID 147507303) is 2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline.
What is the SMILES notation for 2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline?
The canonical SMILES for 2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline is COc1cncc(-c2ccc3nc(C4=Nc5ccccc5C4)ccc3c2)c1.
What is the InChIKey of 2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline?
The InChIKey is FIPAOKPSVWSERP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N3O/c1-27-19-11-18(13-24-14-19)15-6-8-21-17(10-15)7-9-22(25-21)23-12-16-4-2-3-5-20(16)26-23/h2-11,13-14H,12H2,1H3.
What are the key properties of 2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline?
2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline has a molecular weight of 351.41 g/mol, XLogP of 4.98, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3H-indol-2-yl)-6-(5-methoxy-3-pyridinyl)quinoline is sourced from PubChem (CID 147507303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).