[4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine

C13H22N6O — CID 80914000

IUPAC[4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine
SMILESCOc1nc(NN)nc(N2CCC3(CCCC3)CC2)n1
InChIInChI=1S/C13H22N6O/c1-20-12-16-10(18-14)15-11(17-12)19-8-6-13(7-9-19)4-2-3-5-13/h2-9,14H2,1H3,(H,15,16,17,18)
InChIKeyLVSSYDGASVAMIL-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.33
Rot. Bonds3

About [4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine

[4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine (PubChem CID 80914000) has the molecular formula C13H22N6O and a molecular weight of 278.36 g/mol. Its IUPAC name is [4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine
PubChem CID80914000
Molecular FormulaC13H22N6O
Molecular Weight278.36 g/mol
Exact Mass278.19
IUPAC Name[4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine
SMILESCOc1nc(NN)nc(N2CCC3(CCCC3)CC2)n1
InChIInChI=1S/C13H22N6O/c1-20-12-16-10(18-14)15-11(17-12)19-8-6-13(7-9-19)4-2-3-5-13/h2-9,14H2,1H3,(H,15,16,17,18)
InChIKeyLVSSYDGASVAMIL-UHFFFAOYSA-N
XLogP1.33
TPSA89.19 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine?
The IUPAC name of [4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine (CID 80914000) is [4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine.
What is the SMILES notation for [4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine?
The canonical SMILES for [4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine is COc1nc(NN)nc(N2CCC3(CCCC3)CC2)n1.
What is the InChIKey of [4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine?
The InChIKey is LVSSYDGASVAMIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N6O/c1-20-12-16-10(18-14)15-11(17-12)19-8-6-13(7-9-19)4-2-3-5-13/h2-9,14H2,1H3,(H,15,16,17,18).
What are the key properties of [4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine?
[4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine has a molecular weight of 278.36 g/mol, XLogP of 1.33, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine is sourced from PubChem (CID 80914000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).