9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride

C8H18Cl2N2O — CID 75530777

IUPAC9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride
SMILESCN1CCOC2(CCNC2)C1.Cl.Cl
InChIInChI=1S/C8H16N2O.2ClH/c1-10-4-5-11-8(7-10)2-3-9-6-8;;/h9H,2-7H2,1H3;2*1H
InChIKeyUHEKRNCLBHYXHI-UHFFFAOYSA-N
MW229.15 g/mol
LogP0.52
Rot. Bonds

About 9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride

9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride (PubChem CID 75530777) has the molecular formula C8H18Cl2N2O and a molecular weight of 229.15 g/mol. Its IUPAC name is 9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride.

Molecular Properties

Compound Name9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride
PubChem CID75530777
Molecular FormulaC8H18Cl2N2O
Molecular Weight229.15 g/mol
Exact Mass228.08
IUPAC Name9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride
SMILESCN1CCOC2(CCNC2)C1.Cl.Cl
InChIInChI=1S/C8H16N2O.2ClH/c1-10-4-5-11-8(7-10)2-3-9-6-8;;/h9H,2-7H2,1H3;2*1H
InChIKeyUHEKRNCLBHYXHI-UHFFFAOYSA-N
XLogP0.52
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.15
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride?
The IUPAC name of 9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride (CID 75530777) is 9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride.
What is the SMILES notation for 9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride?
The canonical SMILES for 9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride is CN1CCOC2(CCNC2)C1.Cl.Cl.
What is the InChIKey of 9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride?
The InChIKey is UHEKRNCLBHYXHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O.2ClH/c1-10-4-5-11-8(7-10)2-3-9-6-8;;/h9H,2-7H2,1H3;2*1H.
What are the key properties of 9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride?
9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride has a molecular weight of 229.15 g/mol, XLogP of 0.52, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-6-oxa-2,9-diazaspiro[4.5]decane;dihydrochloride is sourced from PubChem (CID 75530777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).