spiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline]

C17H18N2O — CID 10468139

IUPACspiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline]
SMILESc1ccc2nc3c(cc2c1)CC1(CN2CCC1CC2)O3
InChIInChI=1S/C17H18N2O/c1-2-4-15-12(3-1)9-13-10-17(20-16(13)18-15)11-19-7-5-14(17)6-8-19/h1-4,9,14H,5-8,10-11H2
InChIKeyONBISRXFQMIHKY-UHFFFAOYSA-N
MW266.34 g/mol
LogP2.63
Rot. Bonds

About spiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline]

spiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline] (PubChem CID 10468139) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is spiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline].

Molecular Properties

Compound Namespiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline]
PubChem CID10468139
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Namespiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline]
SMILESc1ccc2nc3c(cc2c1)CC1(CN2CCC1CC2)O3
InChIInChI=1S/C17H18N2O/c1-2-4-15-12(3-1)9-13-10-17(20-16(13)18-15)11-19-7-5-14(17)6-8-19/h1-4,9,14H,5-8,10-11H2
InChIKeyONBISRXFQMIHKY-UHFFFAOYSA-N
XLogP2.63
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of spiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline]?
The IUPAC name of spiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline] (CID 10468139) is spiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline].
What is the SMILES notation for spiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline]?
The canonical SMILES for spiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline] is c1ccc2nc3c(cc2c1)CC1(CN2CCC1CC2)O3.
What is the InChIKey of spiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline]?
The InChIKey is ONBISRXFQMIHKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-2-4-15-12(3-1)9-13-10-17(20-16(13)18-15)11-19-7-5-14(17)6-8-19/h1-4,9,14H,5-8,10-11H2.
What are the key properties of spiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline]?
spiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline] has a molecular weight of 266.34 g/mol, XLogP of 2.63, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1-azabicyclo[2.2.2]octane-3,2'-3H-furo[2,3-b]quinoline] is sourced from PubChem (CID 10468139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).