6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile

C15H10N4O — CID 64587987

IUPAC6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile
SMILESN#Cc1cccc(Oc2ccc(N)c3cccnc23)n1
InChIInChI=1S/C15H10N4O/c16-9-10-3-1-5-14(19-10)20-13-7-6-12(17)11-4-2-8-18-15(11)13/h1-8H,17H2
InChIKeyNEMGDNXMHAJYPB-UHFFFAOYSA-N
MW262.27 g/mol
LogP2.88
Rot. Bonds2

About 6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile

6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile (PubChem CID 64587987) has the molecular formula C15H10N4O and a molecular weight of 262.27 g/mol. Its IUPAC name is 6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile.

Molecular Properties

Compound Name6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile
PubChem CID64587987
Molecular FormulaC15H10N4O
Molecular Weight262.27 g/mol
Exact Mass262.09
IUPAC Name6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile
SMILESN#Cc1cccc(Oc2ccc(N)c3cccnc23)n1
InChIInChI=1S/C15H10N4O/c16-9-10-3-1-5-14(19-10)20-13-7-6-12(17)11-4-2-8-18-15(11)13/h1-8H,17H2
InChIKeyNEMGDNXMHAJYPB-UHFFFAOYSA-N
XLogP2.88
TPSA84.82 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile?
The IUPAC name of 6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile (CID 64587987) is 6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile.
What is the SMILES notation for 6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile?
The canonical SMILES for 6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile is N#Cc1cccc(Oc2ccc(N)c3cccnc23)n1.
What is the InChIKey of 6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile?
The InChIKey is NEMGDNXMHAJYPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4O/c16-9-10-3-1-5-14(19-10)20-13-7-6-12(17)11-4-2-8-18-15(11)13/h1-8H,17H2.
What are the key properties of 6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile?
6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile has a molecular weight of 262.27 g/mol, XLogP of 2.88, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-aminoquinolin-8-yl)oxypyridine-2-carbonitrile is sourced from PubChem (CID 64587987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).