2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane

C11H21N — CID 90140966

IUPAC2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane
SMILESCC(C)(C)CN1CC2(CCC2)C1
InChIInChI=1S/C11H21N/c1-10(2,3)7-12-8-11(9-12)5-4-6-11/h4-9H2,1-3H3
InChIKeyLUODVSHOWHGQNC-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.52
Rot. Bonds1

About 2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane

2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane (PubChem CID 90140966) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane.

Molecular Properties

Compound Name2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane
PubChem CID90140966
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane
SMILESCC(C)(C)CN1CC2(CCC2)C1
InChIInChI=1S/C11H21N/c1-10(2,3)7-12-8-11(9-12)5-4-6-11/h4-9H2,1-3H3
InChIKeyLUODVSHOWHGQNC-UHFFFAOYSA-N
XLogP2.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4,4-Dimethylpentyl)-3-fluoroazetidine
CID 57979627
2-Tert-butyl-6,6-difluoro-2-azaspiro[3.3]heptane
CID 118441648
7-Fluoro-2-methyl-2-azaspiro[3.3]heptane
CID 118974389
6-Fluoro-2-methyl-2-azaspiro[3.3]heptane
CID 118974473
2-Tert-butyl-6-fluoro-6-methyl-2-azaspiro[3.3]heptane
CID 121308232
6-Fluoro-2,6-dimethyl-2-azaspiro[3.3]heptane
CID 121313305
3-Fluoro-1-[(3-methylcyclobutyl)methyl]azetidine
CID 123383797
2-Tert-butyl-6-fluoro-2-azaspiro[3.3]heptane
CID 132046341
3-(2,2-Dimethylpropyl)-1-ethyl-3-fluoroazetidine
CID 134509559
2-Tert-butyl-7,7-difluoro-2-azaspiro[3.3]heptane
CID 140929435
7,7-Difluoro-2-methyl-2-azaspiro[3.3]heptane;ethane
CID 145047466
2-Ethyl-6,6-difluoro-2-azaspiro[3.3]heptane
CID 153536147

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane?
The IUPAC name of 2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane (CID 90140966) is 2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane.
What is the SMILES notation for 2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane?
The canonical SMILES for 2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane is CC(C)(C)CN1CC2(CCC2)C1.
What is the InChIKey of 2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane?
The InChIKey is LUODVSHOWHGQNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-10(2,3)7-12-8-11(9-12)5-4-6-11/h4-9H2,1-3H3.
What are the key properties of 2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane?
2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane has a molecular weight of 167.30 g/mol, XLogP of 2.52, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylpropyl)-2-azaspiro[3.3]heptane is sourced from PubChem (CID 90140966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).