2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride

C9H15ClN2O3 — CID 3088285

IUPAC2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride
SMILESCON1C(=O)CC2(CCNCC2)C1=O.Cl
InChIInChI=1S/C9H14N2O3.ClH/c1-14-11-7(12)6-9(8(11)13)2-4-10-5-3-9;/h10H,2-6H2,1H3;1H
InChIKeyAQGQDABWRORTCI-UHFFFAOYSA-N
MW234.68 g/mol
LogP0.10
Rot. Bonds1

About 2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride

2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride (PubChem CID 3088285) has the molecular formula C9H15ClN2O3 and a molecular weight of 234.68 g/mol. Its IUPAC name is 2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride.

Molecular Properties

Compound Name2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride
PubChem CID3088285
Molecular FormulaC9H15ClN2O3
Molecular Weight234.68 g/mol
Exact Mass234.08
IUPAC Name2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride
SMILESCON1C(=O)CC2(CCNCC2)C1=O.Cl
InChIInChI=1S/C9H14N2O3.ClH/c1-14-11-7(12)6-9(8(11)13)2-4-10-5-3-9;/h10H,2-6H2,1H3;1H
InChIKeyAQGQDABWRORTCI-UHFFFAOYSA-N
XLogP0.10
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.68
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride?
The IUPAC name of 2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride (CID 3088285) is 2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride.
What is the SMILES notation for 2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride?
The canonical SMILES for 2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride is CON1C(=O)CC2(CCNCC2)C1=O.Cl.
What is the InChIKey of 2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride?
The InChIKey is AQGQDABWRORTCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O3.ClH/c1-14-11-7(12)6-9(8(11)13)2-4-10-5-3-9;/h10H,2-6H2,1H3;1H.
What are the key properties of 2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride?
2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride has a molecular weight of 234.68 g/mol, XLogP of 0.10, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2,8-diazaspiro[4.5]decane-1,3-dione;hydrochloride is sourced from PubChem (CID 3088285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).