8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone

C15H19FN2O — CID 63977651

IUPAC8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone
SMILESO=C(c1ccc(F)nc1)N1CCC2(CCCC2)CC1
InChIInChI=1S/C15H19FN2O/c16-13-4-3-12(11-17-13)14(19)18-9-7-15(8-10-18)5-1-2-6-15/h3-4,11H,1-2,5-10H2
InChIKeyMXTRYUUUFFJSLK-UHFFFAOYSA-N
MW262.33 g/mol
LogP3.02
Rot. Bonds1

About 8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone

8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone (PubChem CID 63977651) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is 8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone.

Molecular Properties

Compound Name8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone
PubChem CID63977651
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC Name8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone
SMILESO=C(c1ccc(F)nc1)N1CCC2(CCCC2)CC1
InChIInChI=1S/C15H19FN2O/c16-13-4-3-12(11-17-13)14(19)18-9-7-15(8-10-18)5-1-2-6-15/h3-4,11H,1-2,5-10H2
InChIKeyMXTRYUUUFFJSLK-UHFFFAOYSA-N
XLogP3.02
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

3-azaspiro[5.5]undecan-3-yl-(6-fluoro-3-pyridinyl)methanone
CID 63978997
(6-amino-3-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone
CID 63162100
8-azaspiro[4.5]decan-8-yl-[6-(methylamino)-3-pyridinyl]methanone
CID 63161967
(6-fluoro-3-pyridinyl)-(1,4-oxazepan-4-yl)methanone
CID 63979575
(6-fluoro-3-pyridinyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 103719238
(6-fluoro-3-pyridinyl)-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone
CID 63979493
7-(6-fluoropyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonane-2,4-dione
CID 79210280
8-azaspiro[4.5]decan-8-yl-(2-bromo-4-pyridinyl)methanone
CID 103755510
(2-amino-4-pyridinyl)-(8-azaspiro[4.5]decan-8-yl)methanone
CID 63161919
(6-fluoro-3-pyridinyl)-[4-(2-methylpropyl)piperazin-1-yl]methanone
CID 63979723
8-azaspiro[4.5]decan-8-yl-[4-(chloromethyl)phenyl]methanone
CID 63158833
(6-fluoro-3-pyridinyl)-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)methanone
CID 63980528

Frequently Asked Questions

What is the IUPAC name of 8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone?
The IUPAC name of 8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone (CID 63977651) is 8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone.
What is the SMILES notation for 8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone?
The canonical SMILES for 8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone is O=C(c1ccc(F)nc1)N1CCC2(CCCC2)CC1.
What is the InChIKey of 8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone?
The InChIKey is MXTRYUUUFFJSLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O/c16-13-4-3-12(11-17-13)14(19)18-9-7-15(8-10-18)5-1-2-6-15/h3-4,11H,1-2,5-10H2.
What are the key properties of 8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone?
8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone has a molecular weight of 262.33 g/mol, XLogP of 3.02, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-azaspiro[4.5]decan-8-yl-(6-fluoro-3-pyridinyl)methanone is sourced from PubChem (CID 63977651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).