10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane

C20H36N2 — CID 138751441

IUPAC10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane
SMILESC1CCC2(CC1)CCCC(C1CCCC3(CNCCN3)C1)C2
InChIInChI=1S/C20H36N2/c1-2-8-19(9-3-1)10-4-6-17(14-19)18-7-5-11-20(15-18)16-21-12-13-22-20/h17-18,21-22H,1-16H2
InChIKeyGXGSFYZZJKNFIM-UHFFFAOYSA-N
MW304.52 g/mol
LogP4.25
Rot. Bonds1

About 10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane

10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane (PubChem CID 138751441) has the molecular formula C20H36N2 and a molecular weight of 304.52 g/mol. Its IUPAC name is 10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane
PubChem CID138751441
Molecular FormulaC20H36N2
Molecular Weight304.52 g/mol
Exact Mass304.29
IUPAC Name10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane
SMILESC1CCC2(CC1)CCCC(C1CCCC3(CNCCN3)C1)C2
InChIInChI=1S/C20H36N2/c1-2-8-19(9-3-1)10-4-6-17(14-19)18-7-5-11-20(15-18)16-21-12-13-22-20/h17-18,21-22H,1-16H2
InChIKeyGXGSFYZZJKNFIM-UHFFFAOYSA-N
XLogP4.25
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.52
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-diazaspiro[5.6]dodecane
CID 51346047
10-cyclopropyl-3-azaspiro[5.5]undecane
CID 64623012
1,4,8-triazaspiro[5.5]undecane
CID 57350918
spiro[1,3,3a,4,5,6,7,7a-octahydroindene-2,1'-cyclohexane]
CID 123272406
3-spiro[4.6]undecan-9-yl-7,9-diazaspiro[4.6]undecane
CID 123835848
cesium;carbanide;4,7-diazaspiro[2.5]octane
CID 168976829
7-(2-azaspiro[3.4]octan-6-yl)-2,5-diazaspiro[3.4]octane
CID 134443835
(4aS,8aS)-spiro[2,3,4,4a,5,6,8,8a-octahydro-1H-naphthalene-7,4'-piperidine];hydrochloride
CID 131865526
9-fluoro-2,6-diazaspiro[4.5]decane
CID 115012372
8-(8-spiro[4.5]decan-3-yl-2-azaspiro[4.5]decan-2-yl)-2,8-diazaspiro[4.5]decane
CID 167142150
2-(5-azaspiro[3.5]nonan-8-yl)-2-azaspiro[3.5]nonane
CID 79677731
1-azaspiro[4.5]decane
CID 9092

Frequently Asked Questions

What is the IUPAC name of 10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane?
The IUPAC name of 10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane (CID 138751441) is 10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane.
What is the SMILES notation for 10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane?
The canonical SMILES for 10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane is C1CCC2(CC1)CCCC(C1CCCC3(CNCCN3)C1)C2.
What is the InChIKey of 10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane?
The InChIKey is GXGSFYZZJKNFIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H36N2/c1-2-8-19(9-3-1)10-4-6-17(14-19)18-7-5-11-20(15-18)16-21-12-13-22-20/h17-18,21-22H,1-16H2.
What are the key properties of 10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane?
10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane has a molecular weight of 304.52 g/mol, XLogP of 4.25, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-spiro[5.5]undecan-4-yl-1,4-diazaspiro[5.5]undecane is sourced from PubChem (CID 138751441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).