9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane

C13H26N2 — CID 64923852

IUPAC9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane
SMILESCC(C)C(C)N1CCNC2(CCCC2)C1
InChIInChI=1S/C13H26N2/c1-11(2)12(3)15-9-8-14-13(10-15)6-4-5-7-13/h11-12,14H,4-10H2,1-3H3
InChIKeyFVTOCZQZGXMMQU-UHFFFAOYSA-N
MW210.37 g/mol
LogP2.25
Rot. Bonds2

About 9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane

9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane (PubChem CID 64923852) has the molecular formula C13H26N2 and a molecular weight of 210.37 g/mol. Its IUPAC name is 9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane
PubChem CID64923852
Molecular FormulaC13H26N2
Molecular Weight210.37 g/mol
Exact Mass210.21
IUPAC Name9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane
SMILESCC(C)C(C)N1CCNC2(CCCC2)C1
InChIInChI=1S/C13H26N2/c1-11(2)12(3)15-9-8-14-13(10-15)6-4-5-7-13/h11-12,14H,4-10H2,1-3H3
InChIKeyFVTOCZQZGXMMQU-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.37
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane?
The IUPAC name of 9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane (CID 64923852) is 9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane is CC(C)C(C)N1CCNC2(CCCC2)C1.
What is the InChIKey of 9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane?
The InChIKey is FVTOCZQZGXMMQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-11(2)12(3)15-9-8-14-13(10-15)6-4-5-7-13/h11-12,14H,4-10H2,1-3H3.
What are the key properties of 9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane?
9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane has a molecular weight of 210.37 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64923852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).