11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane

C14H20FN3O — CID 118739184

IUPAC11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane
SMILESFc1cccnc1N1CCOCC2(CCCNC2)C1
InChIInChI=1S/C14H20FN3O/c15-12-3-1-6-17-13(12)18-7-8-19-11-14(10-18)4-2-5-16-9-14/h1,3,6,16H,2,4-5,7-11H2
InChIKeyBCFBNHWZAYWJKH-UHFFFAOYSA-N
MW265.33 g/mol
LogP1.43
Rot. Bonds1

About 11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane

11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane (PubChem CID 118739184) has the molecular formula C14H20FN3O and a molecular weight of 265.33 g/mol. Its IUPAC name is 11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane.

Molecular Properties

Compound Name11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane
PubChem CID118739184
Molecular FormulaC14H20FN3O
Molecular Weight265.33 g/mol
Exact Mass265.16
IUPAC Name11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane
SMILESFc1cccnc1N1CCOCC2(CCCNC2)C1
InChIInChI=1S/C14H20FN3O/c15-12-3-1-6-17-13(12)18-7-8-19-11-14(10-18)4-2-5-16-9-14/h1,3,6,16H,2,4-5,7-11H2
InChIKeyBCFBNHWZAYWJKH-UHFFFAOYSA-N
XLogP1.43
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
The IUPAC name of 11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane (CID 118739184) is 11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane.
What is the SMILES notation for 11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
The canonical SMILES for 11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane is Fc1cccnc1N1CCOCC2(CCCNC2)C1.
What is the InChIKey of 11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
The InChIKey is BCFBNHWZAYWJKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3O/c15-12-3-1-6-17-13(12)18-7-8-19-11-14(10-18)4-2-5-16-9-14/h1,3,6,16H,2,4-5,7-11H2.
What are the key properties of 11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane?
11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane has a molecular weight of 265.33 g/mol, XLogP of 1.43, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(3-fluoro-2-pyridinyl)-8-oxa-2,11-diazaspiro[5.6]dodecane is sourced from PubChem (CID 118739184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).