1,8-diazaspiro[4.5]decane;dihydrochloride

C8H18Cl2N2 — CID 50999337

IUPAC1,8-diazaspiro[4.5]decane;dihydrochloride
SMILESC1CNC2(C1)CCNCC2.Cl.Cl
InChIInChI=1S/C8H16N2.2ClH/c1-2-8(10-5-1)3-6-9-7-4-8;;/h9-10H,1-7H2;2*1H
InChIKeyUPHOLJXKVDTBGG-UHFFFAOYSA-N
MW213.15 g/mol
LogP1.34
Rot. Bonds

About 1,8-diazaspiro[4.5]decane;dihydrochloride

1,8-diazaspiro[4.5]decane;dihydrochloride (PubChem CID 50999337) has the molecular formula C8H18Cl2N2 and a molecular weight of 213.15 g/mol. Its IUPAC name is 1,8-diazaspiro[4.5]decane;dihydrochloride.

Molecular Properties

Compound Name1,8-diazaspiro[4.5]decane;dihydrochloride
PubChem CID50999337
Molecular FormulaC8H18Cl2N2
Molecular Weight213.15 g/mol
Exact Mass212.08
IUPAC Name1,8-diazaspiro[4.5]decane;dihydrochloride
SMILESC1CNC2(C1)CCNCC2.Cl.Cl
InChIInChI=1S/C8H16N2.2ClH/c1-2-8(10-5-1)3-6-9-7-4-8;;/h9-10H,1-7H2;2*1H
InChIKeyUPHOLJXKVDTBGG-UHFFFAOYSA-N
XLogP1.34
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.15
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,8-diazaspiro[4.5]decane;dihydrochloride?
The IUPAC name of 1,8-diazaspiro[4.5]decane;dihydrochloride (CID 50999337) is 1,8-diazaspiro[4.5]decane;dihydrochloride.
What is the SMILES notation for 1,8-diazaspiro[4.5]decane;dihydrochloride?
The canonical SMILES for 1,8-diazaspiro[4.5]decane;dihydrochloride is C1CNC2(C1)CCNCC2.Cl.Cl.
What is the InChIKey of 1,8-diazaspiro[4.5]decane;dihydrochloride?
The InChIKey is UPHOLJXKVDTBGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2.2ClH/c1-2-8(10-5-1)3-6-9-7-4-8;;/h9-10H,1-7H2;2*1H.
What are the key properties of 1,8-diazaspiro[4.5]decane;dihydrochloride?
1,8-diazaspiro[4.5]decane;dihydrochloride has a molecular weight of 213.15 g/mol, XLogP of 1.34, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-diazaspiro[4.5]decane;dihydrochloride is sourced from PubChem (CID 50999337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).