8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane

C16H30N2 — CID 59483785

IUPAC8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane
SMILESCC(C)(C)N1CCC2(CCN(C3CCC3)C2)CC1
InChIInChI=1S/C16H30N2/c1-15(2,3)18-11-8-16(9-12-18)7-10-17(13-16)14-5-4-6-14/h14H,4-13H2,1-3H3
InChIKeyKHFCCUQVCGGDGR-UHFFFAOYSA-N
MW250.43 g/mol
LogP3.13
Rot. Bonds1

About 8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane

8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane (PubChem CID 59483785) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is 8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane
PubChem CID59483785
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC Name8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane
SMILESCC(C)(C)N1CCC2(CCN(C3CCC3)C2)CC1
InChIInChI=1S/C16H30N2/c1-15(2,3)18-11-8-16(9-12-18)7-10-17(13-16)14-5-4-6-14/h14H,4-13H2,1-3H3
InChIKeyKHFCCUQVCGGDGR-UHFFFAOYSA-N
XLogP3.13
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.43
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane?
The IUPAC name of 8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane (CID 59483785) is 8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane is CC(C)(C)N1CCC2(CCN(C3CCC3)C2)CC1.
What is the InChIKey of 8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane?
The InChIKey is KHFCCUQVCGGDGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2/c1-15(2,3)18-11-8-16(9-12-18)7-10-17(13-16)14-5-4-6-14/h14H,4-13H2,1-3H3.
What are the key properties of 8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane?
8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane has a molecular weight of 250.43 g/mol, XLogP of 3.13, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-tert-butyl-2-cyclobutyl-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 59483785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).