3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one

C15H23N3O — CID 139516393

IUPAC3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one
SMILESCCc1cnc(N2CCC3(CCCC3)CC2)c(=O)[nH]1
InChIInChI=1S/C15H23N3O/c1-2-12-11-16-13(14(19)17-12)18-9-7-15(8-10-18)5-3-4-6-15/h11H,2-10H2,1H3,(H,17,19)
InChIKeyDNFORCYJDJEKSN-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.49
Rot. Bonds2

About 3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one

3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one (PubChem CID 139516393) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one.

Molecular Properties

Compound Name3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one
PubChem CID139516393
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one
SMILESCCc1cnc(N2CCC3(CCCC3)CC2)c(=O)[nH]1
InChIInChI=1S/C15H23N3O/c1-2-12-11-16-13(14(19)17-12)18-9-7-15(8-10-18)5-3-4-6-15/h11H,2-10H2,1H3,(H,17,19)
InChIKeyDNFORCYJDJEKSN-UHFFFAOYSA-N
XLogP2.49
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one?
The IUPAC name of 3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one (CID 139516393) is 3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one.
What is the SMILES notation for 3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one?
The canonical SMILES for 3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one is CCc1cnc(N2CCC3(CCCC3)CC2)c(=O)[nH]1.
What is the InChIKey of 3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one?
The InChIKey is DNFORCYJDJEKSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-2-12-11-16-13(14(19)17-12)18-9-7-15(8-10-18)5-3-4-6-15/h11H,2-10H2,1H3,(H,17,19).
What are the key properties of 3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one?
3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one has a molecular weight of 261.37 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-azaspiro[4.5]decan-8-yl)-6-ethyl-1H-pyrazin-2-one is sourced from PubChem (CID 139516393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).