9-azaspiro[4.7]dodecane

C11H21N — CID 57036726

IUPAC9-azaspiro[4.7]dodecane
SMILESC1CCC2(C1)CCCNCCC2
InChIInChI=1S/C11H21N/c1-2-6-11(5-1)7-3-9-12-10-4-8-11/h12H,1-10H2
InChIKeySKUJLPNOXPFAKU-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.71
Rot. Bonds

About 9-azaspiro[4.7]dodecane

9-azaspiro[4.7]dodecane (PubChem CID 57036726) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 9-azaspiro[4.7]dodecane.

Molecular Properties

Compound Name9-azaspiro[4.7]dodecane
PubChem CID57036726
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name9-azaspiro[4.7]dodecane
SMILESC1CCC2(C1)CCCNCCC2
InChIInChI=1S/C11H21N/c1-2-6-11(5-1)7-3-9-12-10-4-8-11/h12H,1-10H2
InChIKeySKUJLPNOXPFAKU-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[4.7]dodecane?
The IUPAC name of 9-azaspiro[4.7]dodecane (CID 57036726) is 9-azaspiro[4.7]dodecane.
What is the SMILES notation for 9-azaspiro[4.7]dodecane?
The canonical SMILES for 9-azaspiro[4.7]dodecane is C1CCC2(C1)CCCNCCC2.
What is the InChIKey of 9-azaspiro[4.7]dodecane?
The InChIKey is SKUJLPNOXPFAKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-2-6-11(5-1)7-3-9-12-10-4-8-11/h12H,1-10H2.
What are the key properties of 9-azaspiro[4.7]dodecane?
9-azaspiro[4.7]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[4.7]dodecane is sourced from PubChem (CID 57036726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).