2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile

C15H8ClN3O — CID 24701489

IUPAC2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile
SMILESN#Cc1ccnc(Oc2ccc(Cl)c3cccnc23)c1
InChIInChI=1S/C15H8ClN3O/c16-12-3-4-13(15-11(12)2-1-6-19-15)20-14-8-10(9-17)5-7-18-14/h1-8H
InChIKeyRYLKYOLTNAYJIH-UHFFFAOYSA-N
MW281.70 g/mol
LogP3.95
Rot. Bonds2

About 2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile

2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile (PubChem CID 24701489) has the molecular formula C15H8ClN3O and a molecular weight of 281.70 g/mol. Its IUPAC name is 2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile.

Molecular Properties

Compound Name2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile
PubChem CID24701489
Molecular FormulaC15H8ClN3O
Molecular Weight281.70 g/mol
Exact Mass281.04
IUPAC Name2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile
SMILESN#Cc1ccnc(Oc2ccc(Cl)c3cccnc23)c1
InChIInChI=1S/C15H8ClN3O/c16-12-3-4-13(15-11(12)2-1-6-19-15)20-14-8-10(9-17)5-7-18-14/h1-8H
InChIKeyRYLKYOLTNAYJIH-UHFFFAOYSA-N
XLogP3.95
TPSA58.80 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.70
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile?
The IUPAC name of 2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile (CID 24701489) is 2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile.
What is the SMILES notation for 2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile?
The canonical SMILES for 2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile is N#Cc1ccnc(Oc2ccc(Cl)c3cccnc23)c1.
What is the InChIKey of 2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile?
The InChIKey is RYLKYOLTNAYJIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8ClN3O/c16-12-3-4-13(15-11(12)2-1-6-19-15)20-14-8-10(9-17)5-7-18-14/h1-8H.
What are the key properties of 2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile?
2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile has a molecular weight of 281.70 g/mol, XLogP of 3.95, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile is sourced from PubChem (CID 24701489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).