6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane

C12H24N2 — CID 168820419

IUPAC6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane
SMILESCC1CC2(CN(C)C2)CN1C(C)(C)C
InChIInChI=1S/C12H24N2/c1-10-6-12(7-13(5)8-12)9-14(10)11(2,3)4/h10H,6-9H2,1-5H3
InChIKeyLOAJGROIWGQQOS-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.81
Rot. Bonds

About 6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane

6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane (PubChem CID 168820419) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane.

Molecular Properties

Compound Name6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane
PubChem CID168820419
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane
SMILESCC1CC2(CN(C)C2)CN1C(C)(C)C
InChIInChI=1S/C12H24N2/c1-10-6-12(7-13(5)8-12)9-14(10)11(2,3)4/h10H,6-9H2,1-5H3
InChIKeyLOAJGROIWGQQOS-UHFFFAOYSA-N
XLogP1.81
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane?
The IUPAC name of 6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane (CID 168820419) is 6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane.
What is the SMILES notation for 6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane?
The canonical SMILES for 6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane is CC1CC2(CN(C)C2)CN1C(C)(C)C.
What is the InChIKey of 6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane?
The InChIKey is LOAJGROIWGQQOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-10-6-12(7-13(5)8-12)9-14(10)11(2,3)4/h10H,6-9H2,1-5H3.
What are the key properties of 6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane?
6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane has a molecular weight of 196.34 g/mol, XLogP of 1.81, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane is sourced from PubChem (CID 168820419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).