3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride

C9H16ClN3O2 — CID 75481385

IUPAC3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride
SMILESCl.NCCN1C(=O)NC2(CCCC2)C1=O
InChIInChI=1S/C9H15N3O2.ClH/c10-5-6-12-7(13)9(11-8(12)14)3-1-2-4-9;/h1-6,10H2,(H,11,14);1H
InChIKeyXBTSQPARSREZFC-UHFFFAOYSA-N
MW233.70 g/mol
LogP0.23
Rot. Bonds2

About 3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride

3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride (PubChem CID 75481385) has the molecular formula C9H16ClN3O2 and a molecular weight of 233.70 g/mol. Its IUPAC name is 3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride.

Molecular Properties

Compound Name3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride
PubChem CID75481385
Molecular FormulaC9H16ClN3O2
Molecular Weight233.70 g/mol
Exact Mass233.09
IUPAC Name3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride
SMILESCl.NCCN1C(=O)NC2(CCCC2)C1=O
InChIInChI=1S/C9H15N3O2.ClH/c10-5-6-12-7(13)9(11-8(12)14)3-1-2-4-9;/h1-6,10H2,(H,11,14);1H
InChIKeyXBTSQPARSREZFC-UHFFFAOYSA-N
XLogP0.23
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.70
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride 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

2-(2,4-Dioxo-1,3-diazaspiro(4.4)nonan-3-yl)acetic acid
CID 4996089
1-Acetyl-1,3-diazaspiro(4.4)nonane-2,4-dione
CID 95999
1,3-Diazaspiro(4.4)nonane-2,4-dione, 3-(hydroxymethyl)-
CID 13424
1-Methyl-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 43840157
3-Cyclopentyl-5-isopropyl-imidazolidine-2,4-dione
CID 5273848
1,3-Diazaspiro(4.4)nonane-2,4-dione, 3-(2-hydroxyethyl)-
CID 12831
1,3-Diazaspiro(4.5)decane-2,4-dione, 3-((diethylamino)methyl)-
CID 84787
1,3-Diazaspiro(4.5)decane-2,4-dione, 3-(2-(diethylamino)ethyl)-, hydrochloride
CID 120953
Cypenhymustine
CID 164488
1,3-Diazaspiro(4.4)nonane-2,4-dione, 3-cyclohexyl-
CID 3041342
Hydantoin, 1-(2-propylvaleryl)-
CID 3063773
2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-ethylacetamide
CID 2394115

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride?
The IUPAC name of 3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride (CID 75481385) is 3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride.
What is the SMILES notation for 3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride?
The canonical SMILES for 3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride is Cl.NCCN1C(=O)NC2(CCCC2)C1=O.
What is the InChIKey of 3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride?
The InChIKey is XBTSQPARSREZFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2.ClH/c10-5-6-12-7(13)9(11-8(12)14)3-1-2-4-9;/h1-6,10H2,(H,11,14);1H.
What are the key properties of 3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride?
3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride has a molecular weight of 233.70 g/mol, XLogP of 0.23, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride is sourced from PubChem (CID 75481385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).