5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile

C15H9ClN4O — CID 60923164

IUPAC5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile
SMILESN#Cc1cc(N)cnc1Oc1ccc(Cl)c2cccnc12
InChIInChI=1S/C15H9ClN4O/c16-12-3-4-13(14-11(12)2-1-5-19-14)21-15-9(7-17)6-10(18)8-20-15/h1-6,8H,18H2
InChIKeySCURMCPMAYHNEY-UHFFFAOYSA-N
MW296.72 g/mol
LogP3.53
Rot. Bonds2

About 5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile

5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile (PubChem CID 60923164) has the molecular formula C15H9ClN4O and a molecular weight of 296.72 g/mol. Its IUPAC name is 5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile.

Molecular Properties

Compound Name5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile
PubChem CID60923164
Molecular FormulaC15H9ClN4O
Molecular Weight296.72 g/mol
Exact Mass296.05
IUPAC Name5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile
SMILESN#Cc1cc(N)cnc1Oc1ccc(Cl)c2cccnc12
InChIInChI=1S/C15H9ClN4O/c16-12-3-4-13(14-11(12)2-1-5-19-14)21-15-9(7-17)6-10(18)8-20-15/h1-6,8H,18H2
InChIKeySCURMCPMAYHNEY-UHFFFAOYSA-N
XLogP3.53
TPSA84.82 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.72
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile
CID 107058861
2-amino-5-(5-chloroquinolin-8-yl)oxybenzonitrile
CID 115499745
5-amino-2-(2,3-dichlorophenoxy)pyridine-3-carbonitrile
CID 54860994
4-bromo-2-(5-chloroquinolin-8-yl)oxybenzonitrile
CID 114902377
5-chloro-4-(5-chloroquinolin-8-yl)oxypyrimidin-2-amine
CID 80881381
2-(5-chloroquinolin-8-yl)oxypyridine-4-carbonitrile
CID 24701489
5-amino-2-phenoxypyridine-3-carbonitrile
CID 60923162
5-amino-2-(3,5-dichlorophenoxy)pyridine-3-carbonitrile
CID 54861104
5-amino-2-(3-chloro-4-fluorophenoxy)pyridine-3-carbonitrile
CID 63878450
5-amino-2-(3-ethoxyphenoxy)pyridine-3-carbonitrile
CID 62338626
5-amino-2-(2-fluoro-5-methylphenoxy)pyridine-3-carbonitrile
CID 64854984
5-amino-2-(5-fluoro-2-methylphenoxy)pyridine-3-carbonitrile
CID 102980272

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile?
The IUPAC name of 5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile (CID 60923164) is 5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile.
What is the SMILES notation for 5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile?
The canonical SMILES for 5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile is N#Cc1cc(N)cnc1Oc1ccc(Cl)c2cccnc12.
What is the InChIKey of 5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile?
The InChIKey is SCURMCPMAYHNEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClN4O/c16-12-3-4-13(14-11(12)2-1-5-19-14)21-15-9(7-17)6-10(18)8-20-15/h1-6,8H,18H2.
What are the key properties of 5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile?
5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile has a molecular weight of 296.72 g/mol, XLogP of 3.53, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(5-chloroquinolin-8-yl)oxypyridine-3-carbonitrile is sourced from PubChem (CID 60923164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).