1-(2-fluoroethyl)-1-azaspiro[4.5]decane

C11H20FN — CID 131130404

IUPAC1-(2-fluoroethyl)-1-azaspiro[4.5]decane
SMILESFCCN1CCCC12CCCCC2
InChIInChI=1S/C11H20FN/c12-8-10-13-9-4-7-11(13)5-2-1-3-6-11/h1-10H2
InChIKeyLBLSIZAPJVKXEC-UHFFFAOYSA-N
MW185.29 g/mol
LogP2.75
Rot. Bonds2

About 1-(2-fluoroethyl)-1-azaspiro[4.5]decane

1-(2-fluoroethyl)-1-azaspiro[4.5]decane (PubChem CID 131130404) has the molecular formula C11H20FN and a molecular weight of 185.29 g/mol. Its IUPAC name is 1-(2-fluoroethyl)-1-azaspiro[4.5]decane.

Molecular Properties

Compound Name1-(2-fluoroethyl)-1-azaspiro[4.5]decane
PubChem CID131130404
Molecular FormulaC11H20FN
Molecular Weight185.29 g/mol
Exact Mass185.16
IUPAC Name1-(2-fluoroethyl)-1-azaspiro[4.5]decane
SMILESFCCN1CCCC12CCCCC2
InChIInChI=1S/C11H20FN/c12-8-10-13-9-4-7-11(13)5-2-1-3-6-11/h1-10H2
InChIKeyLBLSIZAPJVKXEC-UHFFFAOYSA-N
XLogP2.75
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.29
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoroethyl)-1-azaspiro[4.5]decane?
The IUPAC name of 1-(2-fluoroethyl)-1-azaspiro[4.5]decane (CID 131130404) is 1-(2-fluoroethyl)-1-azaspiro[4.5]decane.
What is the SMILES notation for 1-(2-fluoroethyl)-1-azaspiro[4.5]decane?
The canonical SMILES for 1-(2-fluoroethyl)-1-azaspiro[4.5]decane is FCCN1CCCC12CCCCC2.
What is the InChIKey of 1-(2-fluoroethyl)-1-azaspiro[4.5]decane?
The InChIKey is LBLSIZAPJVKXEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20FN/c12-8-10-13-9-4-7-11(13)5-2-1-3-6-11/h1-10H2.
What are the key properties of 1-(2-fluoroethyl)-1-azaspiro[4.5]decane?
1-(2-fluoroethyl)-1-azaspiro[4.5]decane has a molecular weight of 185.29 g/mol, XLogP of 2.75, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroethyl)-1-azaspiro[4.5]decane is sourced from PubChem (CID 131130404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).