3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione

C10H15N5O2 — CID 61396486

IUPAC3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
SMILES[N-]=[N+]=NCCN1C(=O)NC2(CCCCC2)C1=O
InChIInChI=1S/C10H15N5O2/c11-14-12-6-7-15-8(16)10(13-9(15)17)4-2-1-3-5-10/h1-7H2,(H,13,17)
InChIKeyGVANPEFQJFKPKW-UHFFFAOYSA-N
MW237.26 g/mol
LogP1.55
Rot. Bonds3

About 3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione

3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione (PubChem CID 61396486) has the molecular formula C10H15N5O2 and a molecular weight of 237.26 g/mol. Its IUPAC name is 3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione.

Molecular Properties

Compound Name3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
PubChem CID61396486
Molecular FormulaC10H15N5O2
Molecular Weight237.26 g/mol
Exact Mass237.12
IUPAC Name3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
SMILES[N-]=[N+]=NCCN1C(=O)NC2(CCCCC2)C1=O
InChIInChI=1S/C10H15N5O2/c11-14-12-6-7-15-8(16)10(13-9(15)17)4-2-1-3-5-10/h1-7H2,(H,13,17)
InChIKeyGVANPEFQJFKPKW-UHFFFAOYSA-N
XLogP1.55
TPSA98.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

Analyze 3-(2-azidoethyl)-1,3-diazaspiro[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

Related Compounds

3-(2-hydroxyethyl)-1,3-diazaspiro[4.7]dodecane-2,4-dione
CID 43509728
3-(2-hydroxyethyl)-1,3-diazaspiro[4.6]undecane-2,4-dione
CID 12866
3-(3-hydroxypropyl)-1,3-diazaspiro[4.7]dodecane-2,4-dione
CID 43509729
3-(2-aminoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
CID 18071047
3-(3-oxobutyl)-1,3-diazaspiro[4.5]decane-2,4-dione
CID 60666732
3-(3-aminopropyl)-1,3-diazaspiro[4.5]decane-2,4-dione
CID 18071372
3-(4-oxopentyl)-1,3-diazaspiro[4.7]dodecane-2,4-dione
CID 62019381
3-(2-azidoethyl)-5-ethyl-5-methylimidazolidine-2,4-dione
CID 61396577
3-(3-aminopropyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 25323207
3-butyl-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 13436719
3-(3-oxo-3-piperidin-1-ylpropyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 35809666
3-(2-oxopropyl)-1,3-diazaspiro[4.5]decane-2,4-dione
CID 7610156

Frequently Asked Questions

What is the IUPAC name of 3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione?
The IUPAC name of 3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione (CID 61396486) is 3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione.
What is the SMILES notation for 3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione?
The canonical SMILES for 3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione is [N-]=[N+]=NCCN1C(=O)NC2(CCCCC2)C1=O.
What is the InChIKey of 3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione?
The InChIKey is GVANPEFQJFKPKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O2/c11-14-12-6-7-15-8(16)10(13-9(15)17)4-2-1-3-5-10/h1-7H2,(H,13,17).
What are the key properties of 3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione?
3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione has a molecular weight of 237.26 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-azidoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione is sourced from PubChem (CID 61396486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).