2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone

C15H21N3O — CID 71999151

IUPAC2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone
SMILESCc1cnc(C(=O)N2CCC3(CCCCC3)C2)cn1
InChIInChI=1S/C15H21N3O/c1-12-9-17-13(10-16-12)14(19)18-8-7-15(11-18)5-3-2-4-6-15/h9-10H,2-8,11H2,1H3
InChIKeyJTUDTLYXXRHSGI-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.58
Rot. Bonds1

About 2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone

2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone (PubChem CID 71999151) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone.

Molecular Properties

Compound Name2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone
PubChem CID71999151
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone
SMILESCc1cnc(C(=O)N2CCC3(CCCCC3)C2)cn1
InChIInChI=1S/C15H21N3O/c1-12-9-17-13(10-16-12)14(19)18-8-7-15(11-18)5-3-2-4-6-15/h9-10H,2-8,11H2,1H3
InChIKeyJTUDTLYXXRHSGI-UHFFFAOYSA-N
XLogP2.58
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(5-methylpyrazin-2-yl)-[9-(2-phenylethyl)-2,9-diazaspiro[4.5]decan-2-yl]methanone
CID 45199217
3-fluoro-1-(5-methylpyrazine-2-carbonyl)pyrrolidine-3-carboxylic acid
CID 119258190
[(2S,3S)-5-(5-methylpyrazine-2-carbonyl)-5-azaspiro[2.4]heptan-2-yl]-pyrrolidin-1-ylmethanone
CID 97492777
(5-methylpyrazin-2-yl)-[4-(piperidine-1-carbonyl)piperazin-1-yl]methanone
CID 30547276
(3,3-diphenylpiperidin-1-yl)-(5-methylpyrazin-2-yl)methanone
CID 72872127
2-azaspiro[4.5]decan-2-yl-(6-methoxypyridazin-3-yl)methanone
CID 71873411
(2-ethoxy-7-azaspiro[3.5]nonan-7-yl)-(5-methylpyrazin-2-yl)methanone
CID 97451244
(4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl)-(5-methylpyrazin-2-yl)methanone
CID 81095354
1-[2-(6-methylpyridine-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]ethanone
CID 134689506
(6R)-1-methyl-8-(5-methylpyrazine-2-carbonyl)-1,8-diazaspiro[5.5]undecan-2-one
CID 97495317
N-[(1R)-1-(6-methyl-3-pyridinyl)ethyl]-2-azaspiro[4.6]undecane-2-carboxamide
CID 126427038
(2S,3R)-N-cyclopropyl-5-(5-methylpyrazine-2-carbonyl)-5-azaspiro[2.4]heptane-2-carboxamide
CID 97493284

Frequently Asked Questions

What is the IUPAC name of 2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone?
The IUPAC name of 2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone (CID 71999151) is 2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone.
What is the SMILES notation for 2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone?
The canonical SMILES for 2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone is Cc1cnc(C(=O)N2CCC3(CCCCC3)C2)cn1.
What is the InChIKey of 2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone?
The InChIKey is JTUDTLYXXRHSGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-12-9-17-13(10-16-12)14(19)18-8-7-15(11-18)5-3-2-4-6-15/h9-10H,2-8,11H2,1H3.
What are the key properties of 2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone?
2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone has a molecular weight of 259.35 g/mol, XLogP of 2.58, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azaspiro[4.5]decan-2-yl-(5-methylpyrazin-2-yl)methanone is sourced from PubChem (CID 71999151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).