2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione

C12H20N2O3 — CID 66886078

IUPAC2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione
SMILESCC(O)CN1C(=O)CC2(CCN(C)CC2)C1=O
InChIInChI=1S/C12H20N2O3/c1-9(15)8-14-10(16)7-12(11(14)17)3-5-13(2)6-4-12/h9,15H,3-8H2,1-2H3
InChIKeySALHQNSBMLVDCA-UHFFFAOYSA-N
MW240.30 g/mol
LogP-0.16
Rot. Bonds2

About 2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione

2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione (PubChem CID 66886078) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is 2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione.

Molecular Properties

Compound Name2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione
PubChem CID66886078
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Name2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione
SMILESCC(O)CN1C(=O)CC2(CCN(C)CC2)C1=O
InChIInChI=1S/C12H20N2O3/c1-9(15)8-14-10(16)7-12(11(14)17)3-5-13(2)6-4-12/h9,15H,3-8H2,1-2H3
InChIKeySALHQNSBMLVDCA-UHFFFAOYSA-N
XLogP-0.16
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 5-0.16
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-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione?
The IUPAC name of 2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione (CID 66886078) is 2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione.
What is the SMILES notation for 2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione?
The canonical SMILES for 2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione is CC(O)CN1C(=O)CC2(CCN(C)CC2)C1=O.
What is the InChIKey of 2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione?
The InChIKey is SALHQNSBMLVDCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c1-9(15)8-14-10(16)7-12(11(14)17)3-5-13(2)6-4-12/h9,15H,3-8H2,1-2H3.
What are the key properties of 2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione?
2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione has a molecular weight of 240.30 g/mol, XLogP of -0.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxypropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione is sourced from PubChem (CID 66886078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).