2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane

C15H29N — CID 134582203

IUPAC2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane
SMILESCC1CCC2(CCCN(C(C)(C)C)C2)CC1
InChIInChI=1S/C15H29N/c1-13-6-9-15(10-7-13)8-5-11-16(12-15)14(2,3)4/h13H,5-12H2,1-4H3
InChIKeyDVZXWYBFRVLKMK-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.08
Rot. Bonds

About 2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane

2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane (PubChem CID 134582203) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane.

Molecular Properties

Compound Name2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane
PubChem CID134582203
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane
SMILESCC1CCC2(CCCN(C(C)(C)C)C2)CC1
InChIInChI=1S/C15H29N/c1-13-6-9-15(10-7-13)8-5-11-16(12-15)14(2,3)4/h13H,5-12H2,1-4H3
InChIKeyDVZXWYBFRVLKMK-UHFFFAOYSA-N
XLogP4.08
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

8-tert-butyl-8-azaspiro[4.5]decane;6-tert-butyl-6-azaspiro[3.5]nonane;7-tert-butyl-7-azaspiro[3.5]nonane;5-tert-butyl-5-azaspiro[2.5]octane;6-tert-butyl-6-azaspiro[2.5]octane;2-tert-butyl-2-azaspiro[5.5]undecane;3-tert-butyl-3-azaspiro[5.5]undecane
CID 159153104
2-tert-butyl-2-azaspiro[4.4]nonane;7-tert-butyl-7-azaspiro[3.5]nonane;6-tert-butyl-6-azaspiro[3.4]octane
CID 167549222
3-methylspiro[5.6]dodecane
CID 143797283
2-tert-butyl-2-azaspiro[3.3]heptane
CID 58166810
7-tert-butyl-2-ethyl-2,7-diazaspiro[4.5]decane
CID 118001208
1-tert-butyl-3,3-dimethylpiperidine
CID 14356856
1-(8-tert-butyl-2,8-diazaspiro[3.5]nonan-2-yl)-2,2-dimethylpropan-1-one
CID 168727113
(3R)-3-methylspiro[4.5]decane
CID 140778087
2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decane
CID 58101749
2,6-ditert-butyl-2-azaspiro[3.3]heptane;2,6-ditert-butyl-2-azaspiro[3.4]octane;2,6-ditert-butyl-6-azaspiro[3.4]octane
CID 161082636
3,9-dimethylspiro[5.5]undecane
CID 20825106
1-(8-tert-butyl-2,8-diazaspiro[3.5]nonan-2-yl)-3,3-dimethylbutan-1-one
CID 168726992

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane?
The IUPAC name of 2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane (CID 134582203) is 2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane.
What is the SMILES notation for 2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane?
The canonical SMILES for 2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane is CC1CCC2(CCCN(C(C)(C)C)C2)CC1.
What is the InChIKey of 2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane?
The InChIKey is DVZXWYBFRVLKMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-13-6-9-15(10-7-13)8-5-11-16(12-15)14(2,3)4/h13H,5-12H2,1-4H3.
What are the key properties of 2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane?
2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane has a molecular weight of 223.40 g/mol, XLogP of 4.08, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-9-methyl-2-azaspiro[5.5]undecane is sourced from PubChem (CID 134582203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).