2-tert-butyl-2-azaspiro[3.3]heptane

C10H19N — CID 58166810

IUPAC2-tert-butyl-2-azaspiro[3.3]heptane
SMILESCC(C)(C)N1CC2(CCC2)C1
InChIInChI=1S/C10H19N/c1-9(2,3)11-7-10(8-11)5-4-6-10/h4-8H2,1-3H3
InChIKeyYSYOXBTUSKQHDW-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.27
Rot. Bonds

About 2-tert-butyl-2-azaspiro[3.3]heptane

2-tert-butyl-2-azaspiro[3.3]heptane (PubChem CID 58166810) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 2-tert-butyl-2-azaspiro[3.3]heptane.

Molecular Properties

Compound Name2-tert-butyl-2-azaspiro[3.3]heptane
PubChem CID58166810
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name2-tert-butyl-2-azaspiro[3.3]heptane
SMILESCC(C)(C)N1CC2(CCC2)C1
InChIInChI=1S/C10H19N/c1-9(2,3)11-7-10(8-11)5-4-6-10/h4-8H2,1-3H3
InChIKeyYSYOXBTUSKQHDW-UHFFFAOYSA-N
XLogP2.27
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 156813146
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CID 166571111
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CID 176722354
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CID 128120643
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CID 130621001
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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-2-azaspiro[3.3]heptane?
The IUPAC name of 2-tert-butyl-2-azaspiro[3.3]heptane (CID 58166810) is 2-tert-butyl-2-azaspiro[3.3]heptane.
What is the SMILES notation for 2-tert-butyl-2-azaspiro[3.3]heptane?
The canonical SMILES for 2-tert-butyl-2-azaspiro[3.3]heptane is CC(C)(C)N1CC2(CCC2)C1.
What is the InChIKey of 2-tert-butyl-2-azaspiro[3.3]heptane?
The InChIKey is YSYOXBTUSKQHDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-9(2,3)11-7-10(8-11)5-4-6-10/h4-8H2,1-3H3.
What are the key properties of 2-tert-butyl-2-azaspiro[3.3]heptane?
2-tert-butyl-2-azaspiro[3.3]heptane has a molecular weight of 153.27 g/mol, XLogP of 2.27, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-2-azaspiro[3.3]heptane is sourced from PubChem (CID 58166810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).