1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane

C12H22N4 — CID 167199390

IUPAC1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane
SMILESC1CC2(CCN2C2CNC3(CNC3)C2)CN1
InChIInChI=1S/C12H22N4/c1-3-13-9-12(1)2-4-16(12)10-5-11(15-6-10)7-14-8-11/h10,13-15H,1-9H2
InChIKeyUGBLEGWQAXPHCQ-UHFFFAOYSA-N
MW222.34 g/mol
LogP-0.87
Rot. Bonds1

About 1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane

1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane (PubChem CID 167199390) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is 1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane.

Molecular Properties

Compound Name1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane
PubChem CID167199390
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC Name1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane
SMILESC1CC2(CCN2C2CNC3(CNC3)C2)CN1
InChIInChI=1S/C12H22N4/c1-3-13-9-12(1)2-4-16(12)10-5-11(15-6-10)7-14-8-11/h10,13-15H,1-9H2
InChIKeyUGBLEGWQAXPHCQ-UHFFFAOYSA-N
XLogP-0.87
TPSA39.33 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 5-0.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane?
The IUPAC name of 1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane (CID 167199390) is 1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane.
What is the SMILES notation for 1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane?
The canonical SMILES for 1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane is C1CC2(CCN2C2CNC3(CNC3)C2)CN1.
What is the InChIKey of 1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane?
The InChIKey is UGBLEGWQAXPHCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-3-13-9-12(1)2-4-16(12)10-5-11(15-6-10)7-14-8-11/h10,13-15H,1-9H2.
What are the key properties of 1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane?
1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane has a molecular weight of 222.34 g/mol, XLogP of -0.87, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-diazaspiro[3.4]octan-7-yl)-1,7-diazaspiro[3.4]octane is sourced from PubChem (CID 167199390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).