8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione

C14H24N4O2 — CID 167995828

IUPAC8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione
SMILESCCN1CCC2(CC1)NC(=O)N(C1CCCNC1)C2=O
InChIInChI=1S/C14H24N4O2/c1-2-17-8-5-14(6-9-17)12(19)18(13(20)16-14)11-4-3-7-15-10-11/h11,15H,2-10H2,1H3,(H,16,20)
InChIKeyZWSSJKMKKFSXTO-UHFFFAOYSA-N
MW280.37 g/mol
LogP0.14
Rot. Bonds2

About 8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione

8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione (PubChem CID 167995828) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is 8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione.

Molecular Properties

Compound Name8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione
PubChem CID167995828
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC Name8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione
SMILESCCN1CCC2(CC1)NC(=O)N(C1CCCNC1)C2=O
InChIInChI=1S/C14H24N4O2/c1-2-17-8-5-14(6-9-17)12(19)18(13(20)16-14)11-4-3-7-15-10-11/h11,15H,2-10H2,1H3,(H,16,20)
InChIKeyZWSSJKMKKFSXTO-UHFFFAOYSA-N
XLogP0.14
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The IUPAC name of 8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione (CID 167995828) is 8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione.
What is the SMILES notation for 8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The canonical SMILES for 8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione is CCN1CCC2(CC1)NC(=O)N(C1CCCNC1)C2=O.
What is the InChIKey of 8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The InChIKey is ZWSSJKMKKFSXTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-2-17-8-5-14(6-9-17)12(19)18(13(20)16-14)11-4-3-7-15-10-11/h11,15H,2-10H2,1H3,(H,16,20).
What are the key properties of 8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione has a molecular weight of 280.37 g/mol, XLogP of 0.14, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-3-piperidin-3-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione is sourced from PubChem (CID 167995828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).