7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane

C17H34N2 — CID 172515504

IUPAC7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane
SMILESCN1CCC2(CCN(C(C)(C)C)C(C(C)(C)C)C2)C1
InChIInChI=1S/C17H34N2/c1-15(2,3)14-12-17(8-10-18(7)13-17)9-11-19(14)16(4,5)6/h14H,8-13H2,1-7H3
InChIKeyYDEBXUVIMGHHSJ-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.62
Rot. Bonds

About 7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane

7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane (PubChem CID 172515504) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane
PubChem CID172515504
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane
SMILESCN1CCC2(CCN(C(C)(C)C)C(C(C)(C)C)C2)C1
InChIInChI=1S/C17H34N2/c1-15(2,3)14-12-17(8-10-18(7)13-17)9-11-19(14)16(4,5)6/h14H,8-13H2,1-7H3
InChIKeyYDEBXUVIMGHHSJ-UHFFFAOYSA-N
XLogP3.62
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-ditert-butyl-2,8-diazaspiro[4.5]decane
CID 153440296
1,2-ditert-butyl-4-cyclopropylpiperidin-4-ol
CID 153289881
2,7-dimethyl-2,7-diazaspiro[4.4]nonane;ethane
CID 144510455
2,2-dimethylpropane;2-methyl-2,8-diazaspiro[4.5]decane
CID 145168180
2,7-dimethyl-2,7-diazaspiro[3.4]octane;ethane
CID 143122018
(5S)-4,5-ditert-butyl-1-methyl-1,4-diazepane
CID 171587505
2-methyl-2-azaspiro[4.4]nonane
CID 59284550
6-tert-butyl-2,7-dimethyl-2,6-diazaspiro[3.4]octane
CID 168820419
1,2-ditert-butyl-4-cyclopropyl-4-ethoxypiperidine
CID 172515542
(2'S)-1',2'-ditert-butylspiro[1,3-dihydroindene-2,4'-pyrrolidine]
CID 58850000
1,2-ditert-butyl-4,4-difluoropiperidine;1,2-ditert-butyl-5,5-difluoropiperidine;1,2-ditert-butyl-4,4-difluoropyrrolidine;1,2-ditert-butyl-4-fluoropyrrolidine
CID 160819870
6-methyl-2-(methylsulfanylmethyl)-6-azaspiro[3.4]octane
CID 146488492

Frequently Asked Questions

What is the IUPAC name of 7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane?
The IUPAC name of 7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane (CID 172515504) is 7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane is CN1CCC2(CCN(C(C)(C)C)C(C(C)(C)C)C2)C1.
What is the InChIKey of 7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane?
The InChIKey is YDEBXUVIMGHHSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-15(2,3)14-12-17(8-10-18(7)13-17)9-11-19(14)16(4,5)6/h14H,8-13H2,1-7H3.
What are the key properties of 7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane?
7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane has a molecular weight of 266.47 g/mol, XLogP of 3.62, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-ditert-butyl-2-methyl-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 172515504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).