2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one

C13H22N2O2 — CID 129372530

IUPAC2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one
SMILESO=C1CC2(CCNCC2)CN1C[C@H]1CCCO1
InChIInChI=1S/C13H22N2O2/c16-12-8-13(3-5-14-6-4-13)10-15(12)9-11-2-1-7-17-11/h11,14H,1-10H2/t11-/m1/s1
InChIKeyMFEMCTDDJMKRNR-LLVKDONJSA-N
MW238.33 g/mol
LogP0.77
Rot. Bonds2

About 2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one

2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one (PubChem CID 129372530) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one.

Molecular Properties

Compound Name2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one
PubChem CID129372530
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one
SMILESO=C1CC2(CCNCC2)CN1C[C@H]1CCCO1
InChIInChI=1S/C13H22N2O2/c16-12-8-13(3-5-14-6-4-13)10-15(12)9-11-2-1-7-17-11/h11,14H,1-10H2/t11-/m1/s1
InChIKeyMFEMCTDDJMKRNR-LLVKDONJSA-N
XLogP0.77
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 ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(oxolan-2-ylmethyl)-1,5-diazocan-2-one
CID 117014385
8-(5-methyl-1,3-oxazole-4-carbonyl)-2-[[(2S)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one
CID 97188197
8-(5-acetylthiophene-2-carbonyl)-2-[[(2S)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one
CID 97192442
8-(2,5-dimethylfuran-3-carbonyl)-2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one
CID 97191551
(5S)-2-(cyclohexylmethyl)-2,7-diazaspiro[4.4]nonan-3-one
CID 155896424
2-[[(2R)-oxolan-2-yl]methyl]-8-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-2,8-diazaspiro[4.5]decan-3-one
CID 97196956
4-(oxolan-2-ylmethyl)-1-oxa-4,9-diazaspiro[5.5]undecane
CID 102567449
1-(oxolan-2-ylmethyl)piperazine-2,6-dione
CID 64982518
9-(3-methylbut-2-enoyl)-2-(oxolan-2-ylmethyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 72891706
8-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]-2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one
CID 97194827
2-[[(2S)-oxolan-2-yl]methyl]-9-(1H-pyrrole-2-carbonyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 97137788
1-(oxolan-2-ylmethyl)piperazine-2,5-dione
CID 64872858

Frequently Asked Questions

What is the IUPAC name of 2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one?
The IUPAC name of 2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one (CID 129372530) is 2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one.
What is the SMILES notation for 2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one?
The canonical SMILES for 2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one is O=C1CC2(CCNCC2)CN1C[C@H]1CCCO1.
What is the InChIKey of 2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one?
The InChIKey is MFEMCTDDJMKRNR-LLVKDONJSA-N. The full InChI is InChI=1S/C13H22N2O2/c16-12-8-13(3-5-14-6-4-13)10-15(12)9-11-2-1-7-17-11/h11,14H,1-10H2/t11-/m1/s1.
What are the key properties of 2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one?
2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one has a molecular weight of 238.33 g/mol, XLogP of 0.77, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2R)-oxolan-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one is sourced from PubChem (CID 129372530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).