1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one

C15H24N2O3 — CID 131932524

IUPAC1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one
SMILESCN1C(=O)CCC12CCN(C(=O)CC1CCOC1)CC2
InChIInChI=1S/C15H24N2O3/c1-16-13(18)2-4-15(16)5-7-17(8-6-15)14(19)10-12-3-9-20-11-12/h12H,2-11H2,1H3
InChIKeyVBKDNLIYTLOTBI-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.03
Rot. Bonds2

About 1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one

1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one (PubChem CID 131932524) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one
PubChem CID131932524
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one
SMILESCN1C(=O)CCC12CCN(C(=O)CC1CCOC1)CC2
InChIInChI=1S/C15H24N2O3/c1-16-13(18)2-4-15(16)5-7-17(8-6-15)14(19)10-12-3-9-20-11-12/h12H,2-11H2,1H3
InChIKeyVBKDNLIYTLOTBI-UHFFFAOYSA-N
XLogP1.03
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

8-(3-cyclohexylpropanoyl)-1-methyl-1,8-diazaspiro[4.5]decan-2-one
CID 26347985
1-morpholin-4-yl-2-(oxan-3-yl)ethanone
CID 110849361
2-[(3S)-oxolan-3-yl]-1-(3-propan-2-ylpyrrolidin-1-yl)ethanone
CID 176724619
1-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)-2-[(3R)-oxolan-3-yl]ethanone
CID 126441295
2-methoxy-1-[1-methyl-4-(oxolan-3-ylmethyl)-1,4,9-triazaspiro[5.5]undecan-9-yl]ethanone
CID 56742423
1-[3-(methylamino)piperidin-1-yl]-2-(oxolan-3-yl)ethanone;hydrochloride
CID 119489417
1-[4-(2-methoxyphenyl)piperidin-1-yl]-2-(oxolan-3-yl)ethanone
CID 119073542
2-cyclopentyl-N-(1-methyl-2-oxo-1-azaspiro[4.5]decan-8-yl)acetamide
CID 97397416
1-[8-(dimethylamino)-8-phenyl-2-azaspiro[4.5]decan-2-yl]-2-(oxolan-3-yl)ethanone
CID 118662319
1-[2-(oxolan-3-ylmethoxy)acetyl]piperidin-4-one
CID 54977254
1-[1-methyl-4-(oxolan-3-ylmethyl)-1,4,9-triazaspiro[5.5]undecan-9-yl]-3-phenylpropan-1-one
CID 56750982
1-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-2-(oxolan-3-yl)ethanone
CID 119065386

Frequently Asked Questions

What is the IUPAC name of 1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one?
The IUPAC name of 1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one (CID 131932524) is 1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for 1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one?
The canonical SMILES for 1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one is CN1C(=O)CCC12CCN(C(=O)CC1CCOC1)CC2.
What is the InChIKey of 1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one?
The InChIKey is VBKDNLIYTLOTBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-16-13(18)2-4-15(16)5-7-17(8-6-15)14(19)10-12-3-9-20-11-12/h12H,2-11H2,1H3.
What are the key properties of 1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one?
1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one has a molecular weight of 280.37 g/mol, XLogP of 1.03, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-8-[2-(oxolan-3-yl)acetyl]-1,8-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 131932524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).