6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one

C13H22N2O2 — CID 83259585

IUPAC6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one
SMILESCC(C)C1NC2(CC2)C(=O)N1C1CCOC1C
InChIInChI=1S/C13H22N2O2/c1-8(2)11-14-13(5-6-13)12(16)15(11)10-4-7-17-9(10)3/h8-11,14H,4-7H2,1-3H3
InChIKeySKUMQTDHQFGWPE-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.11
Rot. Bonds2

About 6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one

6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one (PubChem CID 83259585) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one.

Molecular Properties

Compound Name6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one
PubChem CID83259585
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one
SMILESCC(C)C1NC2(CC2)C(=O)N1C1CCOC1C
InChIInChI=1S/C13H22N2O2/c1-8(2)11-14-13(5-6-13)12(16)15(11)10-4-7-17-9(10)3/h8-11,14H,4-7H2,1-3H3
InChIKeySKUMQTDHQFGWPE-UHFFFAOYSA-N
XLogP1.11
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one
CID 83260746
6-(2,4-dimethylcyclohexyl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one
CID 83264077
6-cycloheptyl-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one
CID 83244558
6-(1,1-dioxothian-4-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one
CID 83243550
3,3,6-trimethyl-1-(2-methyloxolan-3-yl)piperazine-2,5-dione
CID 82736694
6-(dicyclopropylmethyl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one
CID 83252344
3,6-diethyl-3-methyl-1-(2-methyloxolan-3-yl)piperazine-2,5-dione
CID 82737026
6-ethyl-1-(2-methyloxolan-3-yl)-3-(2-methylpropyl)piperazine-2,5-dione
CID 82737139
5-butan-2-yl-2-ethyl-3-(2-methyloxolan-3-yl)imidazolidin-4-one
CID 83259587
6-(2-cyclohexylethyl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one
CID 83256857
6-(4-methylhexan-2-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one
CID 83263260
5-ethyl-6-(2-methylcyclohexyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83237288

Frequently Asked Questions

What is the IUPAC name of 6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one?
The IUPAC name of 6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one (CID 83259585) is 6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one.
What is the SMILES notation for 6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one?
The canonical SMILES for 6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one is CC(C)C1NC2(CC2)C(=O)N1C1CCOC1C.
What is the InChIKey of 6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one?
The InChIKey is SKUMQTDHQFGWPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-8(2)11-14-13(5-6-13)12(16)15(11)10-4-7-17-9(10)3/h8-11,14H,4-7H2,1-3H3.
What are the key properties of 6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one?
6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one has a molecular weight of 238.33 g/mol, XLogP of 1.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methyloxolan-3-yl)-5-propan-2-yl-4,6-diazaspiro[2.4]heptan-7-one is sourced from PubChem (CID 83259585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).