11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane

C13H25FN2 — CID 81113477

IUPAC11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane
SMILESFCCCN1CCCNC2(CCCCC2)C1
InChIInChI=1S/C13H25FN2/c14-8-4-10-16-11-5-9-15-13(12-16)6-2-1-3-7-13/h15H,1-12H2
InChIKeyDSIITZNLZQQATR-UHFFFAOYSA-N
MW228.35 g/mol
LogP2.34
Rot. Bonds3

About 11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane

11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane (PubChem CID 81113477) has the molecular formula C13H25FN2 and a molecular weight of 228.35 g/mol. Its IUPAC name is 11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane.

Molecular Properties

Compound Name11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane
PubChem CID81113477
Molecular FormulaC13H25FN2
Molecular Weight228.35 g/mol
Exact Mass228.20
IUPAC Name11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane
SMILESFCCCN1CCCNC2(CCCCC2)C1
InChIInChI=1S/C13H25FN2/c14-8-4-10-16-11-5-9-15-13(12-16)6-2-1-3-7-13/h15H,1-12H2
InChIKeyDSIITZNLZQQATR-UHFFFAOYSA-N
XLogP2.34
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.35
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane?
The IUPAC name of 11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane (CID 81113477) is 11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane.
What is the SMILES notation for 11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane?
The canonical SMILES for 11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane is FCCCN1CCCNC2(CCCCC2)C1.
What is the InChIKey of 11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane?
The InChIKey is DSIITZNLZQQATR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25FN2/c14-8-4-10-16-11-5-9-15-13(12-16)6-2-1-3-7-13/h15H,1-12H2.
What are the key properties of 11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane?
11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane has a molecular weight of 228.35 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(3-fluoropropyl)-7,11-diazaspiro[5.6]dodecane is sourced from PubChem (CID 81113477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).