3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one

C14H26N2O — CID 139708487

IUPAC3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one
SMILESCCC1CNC2(CC(C)(C)NC(C)(C)C2)C1=O
InChIInChI=1S/C14H26N2O/c1-6-10-7-15-14(11(10)17)8-12(2,3)16-13(4,5)9-14/h10,15-16H,6-9H2,1-5H3
InChIKeyONSFITOATZABMX-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.86
Rot. Bonds1

About 3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one

3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one (PubChem CID 139708487) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one.

Molecular Properties

Compound Name3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one
PubChem CID139708487
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one
SMILESCCC1CNC2(CC(C)(C)NC(C)(C)C2)C1=O
InChIInChI=1S/C14H26N2O/c1-6-10-7-15-14(11(10)17)8-12(2,3)16-13(4,5)9-14/h10,15-16H,6-9H2,1-5H3
InChIKeyONSFITOATZABMX-UHFFFAOYSA-N
XLogP1.86
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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7,7,9,9-tetramethyl-3-octyl-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 11267711
2-ethyl-7,7,9,9-tetramethyl-1-oxa-4,8-diazaspiro[4.5]decan-3-one;2,7,7,9,9-pentamethyl-1-oxa-4,8-diazaspiro[4.5]decan-3-one
CID 160595968
4-ethyl-2,2-dimethylcyclohexane-1,3-dione
CID 67984878
2,2-diethyl-7,7,9,9-tetramethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one
CID 6454848
(3S)-3,5,5-trimethyl-3-propan-2-ylpyrrolidin-2-one
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(5R)-5-ethylpiperidine-2,4-dione
CID 86318642
4-ethyl-3,3-dimethylpyrrolidin-2-one
CID 144542846
(3S,8aS)-3-ethyl-8a-methyl-2,3-dihydroazulen-1-one
CID 100934443
bis(2,2,6,6-tetramethylpiperidin-4-one);hydrochloride
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(4S)-4-butyl-2,2-dimethylpyrrolidine
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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one?
The IUPAC name of 3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one (CID 139708487) is 3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one.
What is the SMILES notation for 3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one?
The canonical SMILES for 3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one is CCC1CNC2(CC(C)(C)NC(C)(C)C2)C1=O.
What is the InChIKey of 3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one?
The InChIKey is ONSFITOATZABMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-6-10-7-15-14(11(10)17)8-12(2,3)16-13(4,5)9-14/h10,15-16H,6-9H2,1-5H3.
What are the key properties of 3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one?
3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one has a molecular weight of 238.37 g/mol, XLogP of 1.86, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-7,7,9,9-tetramethyl-1,8-diazaspiro[4.5]decan-4-one is sourced from PubChem (CID 139708487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).