3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione

C14H26N4O2 — CID 26220097

IUPAC3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione
SMILESCCN1C(=O)N(CCN(C)C)C(=O)C12CCN(C)CC2
InChIInChI=1S/C14H26N4O2/c1-5-18-13(20)17(11-10-15(2)3)12(19)14(18)6-8-16(4)9-7-14/h5-11H2,1-4H3
InChIKeyRBZNZASFVGAQGK-UHFFFAOYSA-N
MW282.39 g/mol
LogP0.30
Rot. Bonds4

About 3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione

3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione (PubChem CID 26220097) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione.

Molecular Properties

Compound Name3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione
PubChem CID26220097
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione
SMILESCCN1C(=O)N(CCN(C)C)C(=O)C12CCN(C)CC2
InChIInChI=1S/C14H26N4O2/c1-5-18-13(20)17(11-10-15(2)3)12(19)14(18)6-8-16(4)9-7-14/h5-11H2,1-4H3
InChIKeyRBZNZASFVGAQGK-UHFFFAOYSA-N
XLogP0.30
TPSA47.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

3-[2-(dimethylamino)ethyl]-1-ethyl-8-(2-methylpropyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 26233119
3-[2-(dimethylamino)ethyl]-1-ethyl-8-[[5-(hydroxymethyl)furan-2-yl]methyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 26220254
3-[2-(dimethylamino)ethyl]-1-ethyl-8-(1-pyridin-3-ylpropan-2-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 45163207
3-[2-(dimethylamino)ethyl]-8-[(1,5-dimethylpyrazol-4-yl)methyl]-1-(3-methylbutyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 26144350
3-[2-(dimethylamino)ethyl]-8-[(3-methoxyphenyl)methyl]-1-(3-methylbutyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 26224173
3-[2-(dimethylamino)ethyl]-8-(1H-indol-2-ylmethyl)-1-(3-methylbutyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 26215296
17-[2-(dimethylamino)ethyl]-1',3'-diethyl-4,10-dihydroxyspiro[17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-13,5'-imidazolidine]-2',4'-dione
CID 123265810
1-ethyl-3-methyl-8-[(2S)-1-methylsulfanylpropan-2-yl]-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 26221856
2-(1,3-diethyl-2,4-dioxo-1,3,8-triazaspiro[4.5]decan-8-yl)-5-hydroxy-1-methyl-6-oxopyrimidine-4-carboxamide
CID 143146381
1-[2-(dimethylamino)ethyl]-4,7,7-trimethyl-1,4-diazepan-2-one
CID 139401205
1-ethyl-8-[(2R)-1-methylsulfanylpropan-2-yl]-3-(3-pyridin-3-ylpropyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 26143532
3-[3-(dimethylamino)propyl]-1-(2-phenylethyl)-8-[(3S)-thiolan-3-yl]-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 26228838

Frequently Asked Questions

What is the IUPAC name of 3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The IUPAC name of 3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione (CID 26220097) is 3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione.
What is the SMILES notation for 3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The canonical SMILES for 3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione is CCN1C(=O)N(CCN(C)C)C(=O)C12CCN(C)CC2.
What is the InChIKey of 3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The InChIKey is RBZNZASFVGAQGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-5-18-13(20)17(11-10-15(2)3)12(19)14(18)6-8-16(4)9-7-14/h5-11H2,1-4H3.
What are the key properties of 3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione has a molecular weight of 282.39 g/mol, XLogP of 0.30, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(dimethylamino)ethyl]-1-ethyl-8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione is sourced from PubChem (CID 26220097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).