2,9-diazaspiro[4.7]dodecane

C10H20N2 — CID 54325706

IUPAC2,9-diazaspiro[4.7]dodecane
SMILESC1CNCCCC2(C1)CCNC2
InChIInChI=1S/C10H20N2/c1-3-10(5-8-12-9-10)4-2-7-11-6-1/h11-12H,1-9H2
InChIKeyXIGNUTNVPWBKBU-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.13
Rot. Bonds

About 2,9-diazaspiro[4.7]dodecane

2,9-diazaspiro[4.7]dodecane (PubChem CID 54325706) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 2,9-diazaspiro[4.7]dodecane.

Molecular Properties

Compound Name2,9-diazaspiro[4.7]dodecane
PubChem CID54325706
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name2,9-diazaspiro[4.7]dodecane
SMILESC1CNCCCC2(C1)CCNC2
InChIInChI=1S/C10H20N2/c1-3-10(5-8-12-9-10)4-2-7-11-6-1/h11-12H,1-9H2
InChIKeyXIGNUTNVPWBKBU-UHFFFAOYSA-N
XLogP1.13
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,9-diazaspiro[4.7]dodecane?
The IUPAC name of 2,9-diazaspiro[4.7]dodecane (CID 54325706) is 2,9-diazaspiro[4.7]dodecane.
What is the SMILES notation for 2,9-diazaspiro[4.7]dodecane?
The canonical SMILES for 2,9-diazaspiro[4.7]dodecane is C1CNCCCC2(C1)CCNC2.
What is the InChIKey of 2,9-diazaspiro[4.7]dodecane?
The InChIKey is XIGNUTNVPWBKBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-3-10(5-8-12-9-10)4-2-7-11-6-1/h11-12H,1-9H2.
What are the key properties of 2,9-diazaspiro[4.7]dodecane?
2,9-diazaspiro[4.7]dodecane has a molecular weight of 168.28 g/mol, XLogP of 1.13, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,9-diazaspiro[4.7]dodecane is sourced from PubChem (CID 54325706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).