7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one

C14H20N4O — CID 70653918

IUPAC7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one
SMILESCc1cncc(N2CCC3(CCCC(N)C3)C2=O)n1
InChIInChI=1S/C14H20N4O/c1-10-8-16-9-12(17-10)18-6-5-14(13(18)19)4-2-3-11(15)7-14/h8-9,11H,2-7,15H2,1H3
InChIKeyXYXAPRSQZHRIRQ-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.41
Rot. Bonds1

About 7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one

7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one (PubChem CID 70653918) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one
PubChem CID70653918
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one
SMILESCc1cncc(N2CCC3(CCCC(N)C3)C2=O)n1
InChIInChI=1S/C14H20N4O/c1-10-8-16-9-12(17-10)18-6-5-14(13(18)19)4-2-3-11(15)7-14/h8-9,11H,2-7,15H2,1H3
InChIKeyXYXAPRSQZHRIRQ-UHFFFAOYSA-N
XLogP1.41
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one?
The IUPAC name of 7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one (CID 70653918) is 7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one.
What is the SMILES notation for 7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one?
The canonical SMILES for 7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one is Cc1cncc(N2CCC3(CCCC(N)C3)C2=O)n1.
What is the InChIKey of 7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one?
The InChIKey is XYXAPRSQZHRIRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-10-8-16-9-12(17-10)18-6-5-14(13(18)19)4-2-3-11(15)7-14/h8-9,11H,2-7,15H2,1H3.
What are the key properties of 7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one?
7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one has a molecular weight of 260.34 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-2-(6-methylpyrazin-2-yl)-2-azaspiro[4.5]decan-1-one is sourced from PubChem (CID 70653918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).