2,3-ditert-butyl-2,8-diazaspiro[4.5]decane

C16H32N2 — CID 153440296

IUPAC2,3-ditert-butyl-2,8-diazaspiro[4.5]decane
SMILESCC(C)(C)C1CC2(CCNCC2)CN1C(C)(C)C
InChIInChI=1S/C16H32N2/c1-14(2,3)13-11-16(7-9-17-10-8-16)12-18(13)15(4,5)6/h13,17H,7-12H2,1-6H3
InChIKeySWXCIWWEOYFKDM-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.28
Rot. Bonds

About 2,3-ditert-butyl-2,8-diazaspiro[4.5]decane

2,3-ditert-butyl-2,8-diazaspiro[4.5]decane (PubChem CID 153440296) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 2,3-ditert-butyl-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name2,3-ditert-butyl-2,8-diazaspiro[4.5]decane
PubChem CID153440296
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name2,3-ditert-butyl-2,8-diazaspiro[4.5]decane
SMILESCC(C)(C)C1CC2(CCNCC2)CN1C(C)(C)C
InChIInChI=1S/C16H32N2/c1-14(2,3)13-11-16(7-9-17-10-8-16)12-18(13)15(4,5)6/h13,17H,7-12H2,1-6H3
InChIKeySWXCIWWEOYFKDM-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-ditert-butyl-2,8-diazaspiro[4.5]decane?
The IUPAC name of 2,3-ditert-butyl-2,8-diazaspiro[4.5]decane (CID 153440296) is 2,3-ditert-butyl-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 2,3-ditert-butyl-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 2,3-ditert-butyl-2,8-diazaspiro[4.5]decane is CC(C)(C)C1CC2(CCNCC2)CN1C(C)(C)C.
What is the InChIKey of 2,3-ditert-butyl-2,8-diazaspiro[4.5]decane?
The InChIKey is SWXCIWWEOYFKDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-14(2,3)13-11-16(7-9-17-10-8-16)12-18(13)15(4,5)6/h13,17H,7-12H2,1-6H3.
What are the key properties of 2,3-ditert-butyl-2,8-diazaspiro[4.5]decane?
2,3-ditert-butyl-2,8-diazaspiro[4.5]decane has a molecular weight of 252.45 g/mol, XLogP of 3.28, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-ditert-butyl-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 153440296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).