2-(2-isoquinolin-7-yloxyethyl)quinoline

C20H16N2O — CID 24946059

IUPAC2-(2-isoquinolin-7-yloxyethyl)quinoline
SMILESc1ccc2nc(CCOc3ccc4ccncc4c3)ccc2c1
InChIInChI=1S/C20H16N2O/c1-2-4-20-16(3-1)5-7-18(22-20)10-12-23-19-8-6-15-9-11-21-14-17(15)13-19/h1-9,11,13-14H,10,12H2
InChIKeyRPAPWIFTZCSMEY-UHFFFAOYSA-N
MW300.36 g/mol
LogP4.40
Rot. Bonds4

About 2-(2-isoquinolin-7-yloxyethyl)quinoline

2-(2-isoquinolin-7-yloxyethyl)quinoline (PubChem CID 24946059) has the molecular formula C20H16N2O and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-(2-isoquinolin-7-yloxyethyl)quinoline.

Molecular Properties

Compound Name2-(2-isoquinolin-7-yloxyethyl)quinoline
PubChem CID24946059
Molecular FormulaC20H16N2O
Molecular Weight300.36 g/mol
Exact Mass300.13
IUPAC Name2-(2-isoquinolin-7-yloxyethyl)quinoline
SMILESc1ccc2nc(CCOc3ccc4ccncc4c3)ccc2c1
InChIInChI=1S/C20H16N2O/c1-2-4-20-16(3-1)5-7-18(22-20)10-12-23-19-8-6-15-9-11-21-14-17(15)13-19/h1-9,11,13-14H,10,12H2
InChIKeyRPAPWIFTZCSMEY-UHFFFAOYSA-N
XLogP4.40
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-isoquinolin-7-yloxyethyl)quinoline?
The IUPAC name of 2-(2-isoquinolin-7-yloxyethyl)quinoline (CID 24946059) is 2-(2-isoquinolin-7-yloxyethyl)quinoline.
What is the SMILES notation for 2-(2-isoquinolin-7-yloxyethyl)quinoline?
The canonical SMILES for 2-(2-isoquinolin-7-yloxyethyl)quinoline is c1ccc2nc(CCOc3ccc4ccncc4c3)ccc2c1.
What is the InChIKey of 2-(2-isoquinolin-7-yloxyethyl)quinoline?
The InChIKey is RPAPWIFTZCSMEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O/c1-2-4-20-16(3-1)5-7-18(22-20)10-12-23-19-8-6-15-9-11-21-14-17(15)13-19/h1-9,11,13-14H,10,12H2.
What are the key properties of 2-(2-isoquinolin-7-yloxyethyl)quinoline?
2-(2-isoquinolin-7-yloxyethyl)quinoline has a molecular weight of 300.36 g/mol, XLogP of 4.40, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-isoquinolin-7-yloxyethyl)quinoline is sourced from PubChem (CID 24946059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).