9-azaspiro[5.6]dodecane

C11H21N — CID 58531234

IUPAC9-azaspiro[5.6]dodecane
SMILESC1CCC2(CC1)CCCNCC2
InChIInChI=1S/C11H21N/c1-2-5-11(6-3-1)7-4-9-12-10-8-11/h12H,1-10H2
InChIKeyZWAATVZJDIHKSZ-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.71
Rot. Bonds

About 9-azaspiro[5.6]dodecane

9-azaspiro[5.6]dodecane (PubChem CID 58531234) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 9-azaspiro[5.6]dodecane.

Molecular Properties

Compound Name9-azaspiro[5.6]dodecane
PubChem CID58531234
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name9-azaspiro[5.6]dodecane
SMILESC1CCC2(CC1)CCCNCC2
InChIInChI=1S/C11H21N/c1-2-5-11(6-3-1)7-4-9-12-10-8-11/h12H,1-10H2
InChIKeyZWAATVZJDIHKSZ-UHFFFAOYSA-N
XLogP2.71
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-azaspiro[5.6]dodecane?
The IUPAC name of 9-azaspiro[5.6]dodecane (CID 58531234) is 9-azaspiro[5.6]dodecane.
What is the SMILES notation for 9-azaspiro[5.6]dodecane?
The canonical SMILES for 9-azaspiro[5.6]dodecane is C1CCC2(CC1)CCCNCC2.
What is the InChIKey of 9-azaspiro[5.6]dodecane?
The InChIKey is ZWAATVZJDIHKSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-2-5-11(6-3-1)7-4-9-12-10-8-11/h12H,1-10H2.
What are the key properties of 9-azaspiro[5.6]dodecane?
9-azaspiro[5.6]dodecane has a molecular weight of 167.30 g/mol, XLogP of 2.71, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-azaspiro[5.6]dodecane is sourced from PubChem (CID 58531234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).