2-(2-azaspiro[3.5]nonan-7-yl)quinoline

C17H20N2 — CID 175711459

IUPAC2-(2-azaspiro[3.5]nonan-7-yl)quinoline
SMILESc1ccc2nc(C3CCC4(CC3)CNC4)ccc2c1
InChIInChI=1S/C17H20N2/c1-2-4-15-13(3-1)5-6-16(19-15)14-7-9-17(10-8-14)11-18-12-17/h1-6,14,18H,7-12H2
InChIKeyQCSAPGBTKXWRGI-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.48
Rot. Bonds1

About 2-(2-azaspiro[3.5]nonan-7-yl)quinoline

2-(2-azaspiro[3.5]nonan-7-yl)quinoline (PubChem CID 175711459) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-(2-azaspiro[3.5]nonan-7-yl)quinoline.

Molecular Properties

Compound Name2-(2-azaspiro[3.5]nonan-7-yl)quinoline
PubChem CID175711459
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC Name2-(2-azaspiro[3.5]nonan-7-yl)quinoline
SMILESc1ccc2nc(C3CCC4(CC3)CNC4)ccc2c1
InChIInChI=1S/C17H20N2/c1-2-4-15-13(3-1)5-6-16(19-15)14-7-9-17(10-8-14)11-18-12-17/h1-6,14,18H,7-12H2
InChIKeyQCSAPGBTKXWRGI-UHFFFAOYSA-N
XLogP3.48
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-azaspiro[3.5]nonan-7-yl)quinoline?
The IUPAC name of 2-(2-azaspiro[3.5]nonan-7-yl)quinoline (CID 175711459) is 2-(2-azaspiro[3.5]nonan-7-yl)quinoline.
What is the SMILES notation for 2-(2-azaspiro[3.5]nonan-7-yl)quinoline?
The canonical SMILES for 2-(2-azaspiro[3.5]nonan-7-yl)quinoline is c1ccc2nc(C3CCC4(CC3)CNC4)ccc2c1.
What is the InChIKey of 2-(2-azaspiro[3.5]nonan-7-yl)quinoline?
The InChIKey is QCSAPGBTKXWRGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-2-4-15-13(3-1)5-6-16(19-15)14-7-9-17(10-8-14)11-18-12-17/h1-6,14,18H,7-12H2.
What are the key properties of 2-(2-azaspiro[3.5]nonan-7-yl)quinoline?
2-(2-azaspiro[3.5]nonan-7-yl)quinoline has a molecular weight of 252.36 g/mol, XLogP of 3.48, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-azaspiro[3.5]nonan-7-yl)quinoline is sourced from PubChem (CID 175711459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).