2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane

C11H23N3 — CID 11344615

IUPAC2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane
SMILESCC(C)N1CNCCC12CCN(C)C2
InChIInChI=1S/C11H23N3/c1-10(2)14-9-12-6-4-11(14)5-7-13(3)8-11/h10,12H,4-9H2,1-3H3
InChIKeyHGSCQCJQYUGYIO-UHFFFAOYSA-N
MW197.33 g/mol
LogP0.72
Rot. Bonds1

About 2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane

2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane (PubChem CID 11344615) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is 2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane.

Molecular Properties

Compound Name2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane
PubChem CID11344615
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC Name2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane
SMILESCC(C)N1CNCCC12CCN(C)C2
InChIInChI=1S/C11H23N3/c1-10(2)14-9-12-6-4-11(14)5-7-13(3)8-11/h10,12H,4-9H2,1-3H3
InChIKeyHGSCQCJQYUGYIO-UHFFFAOYSA-N
XLogP0.72
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane?
The IUPAC name of 2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane (CID 11344615) is 2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane.
What is the SMILES notation for 2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane?
The canonical SMILES for 2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane is CC(C)N1CNCCC12CCN(C)C2.
What is the InChIKey of 2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane?
The InChIKey is HGSCQCJQYUGYIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-10(2)14-9-12-6-4-11(14)5-7-13(3)8-11/h10,12H,4-9H2,1-3H3.
What are the key properties of 2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane?
2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane has a molecular weight of 197.33 g/mol, XLogP of 0.72, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-propan-2-yl-2,6,8-triazaspiro[4.5]decane is sourced from PubChem (CID 11344615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).