6-decyl-6,9-diazaspiro[4.5]decane

C18H36N2 — CID 64844428

IUPAC6-decyl-6,9-diazaspiro[4.5]decane
SMILESCCCCCCCCCCN1CCNCC12CCCC2
InChIInChI=1S/C18H36N2/c1-2-3-4-5-6-7-8-11-15-20-16-14-19-17-18(20)12-9-10-13-18/h19H,2-17H2,1H3
InChIKeyNRGGAPKGVJSMLY-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.35
Rot. Bonds9

About 6-decyl-6,9-diazaspiro[4.5]decane

6-decyl-6,9-diazaspiro[4.5]decane (PubChem CID 64844428) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is 6-decyl-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name6-decyl-6,9-diazaspiro[4.5]decane
PubChem CID64844428
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC Name6-decyl-6,9-diazaspiro[4.5]decane
SMILESCCCCCCCCCCN1CCNCC12CCCC2
InChIInChI=1S/C18H36N2/c1-2-3-4-5-6-7-8-11-15-20-16-14-19-17-18(20)12-9-10-13-18/h19H,2-17H2,1H3
InChIKeyNRGGAPKGVJSMLY-UHFFFAOYSA-N
XLogP4.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.50
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-decyl-6,9-diazaspiro[4.5]decane?
The IUPAC name of 6-decyl-6,9-diazaspiro[4.5]decane (CID 64844428) is 6-decyl-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 6-decyl-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 6-decyl-6,9-diazaspiro[4.5]decane is CCCCCCCCCCN1CCNCC12CCCC2.
What is the InChIKey of 6-decyl-6,9-diazaspiro[4.5]decane?
The InChIKey is NRGGAPKGVJSMLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-2-3-4-5-6-7-8-11-15-20-16-14-19-17-18(20)12-9-10-13-18/h19H,2-17H2,1H3.
What are the key properties of 6-decyl-6,9-diazaspiro[4.5]decane?
6-decyl-6,9-diazaspiro[4.5]decane has a molecular weight of 280.50 g/mol, XLogP of 4.35, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-decyl-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64844428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).