5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione

C9H13N5O2S — CID 62207837

IUPAC5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione
SMILESCNc1snnc1CN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C9H13N5O2S/c1-9(2)7(15)14(8(16)11-9)4-5-6(10-3)17-13-12-5/h10H,4H2,1-3H3,(H,11,16)
InChIKeyZYZUFJOLOFVRAE-UHFFFAOYSA-N
MW255.30 g/mol
LogP0.41
Rot. Bonds3

About 5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione

5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione (PubChem CID 62207837) has the molecular formula C9H13N5O2S and a molecular weight of 255.30 g/mol. Its IUPAC name is 5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione
PubChem CID62207837
Molecular FormulaC9H13N5O2S
Molecular Weight255.30 g/mol
Exact Mass255.08
IUPAC Name5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione
SMILESCNc1snnc1CN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C9H13N5O2S/c1-9(2)7(15)14(8(16)11-9)4-5-6(10-3)17-13-12-5/h10H,4H2,1-3H3,(H,11,16)
InChIKeyZYZUFJOLOFVRAE-UHFFFAOYSA-N
XLogP0.41
TPSA87.22 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.30
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-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

1-Acetyl-5-methyl-3-(4-methyl-1,2,3-thiadiazol-5-yl)imidazolidine-2,4-dione
CID 129875569
3-[[5-(Ethylamino)thiadiazol-4-yl]methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione
CID 64265487
5-Methyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]-5-(trifluoromethyl)imidazolidine-2,4-dione
CID 64265689
3-[(5-Aminothiadiazol-4-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione
CID 64265690
3-[(5-Hydrazinylthiadiazol-4-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione
CID 64266099
1-Methyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4,5-trione
CID 55044679
3-Methyl-1-[[5-(propylamino)thiadiazol-4-yl]methyl]pyrrolidine-2,5-dione
CID 55044825
N-ethyl-2-[[5-(ethylamino)thiadiazol-4-yl]methyl-methylamino]acetamide
CID 55046180
2-[methyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-N-propan-2-ylacetamide
CID 55046232
2-[[5-(ethylamino)thiadiazol-4-yl]methyl-methylamino]-N-propylacetamide
CID 55046322
2-[ethyl-[[5-(ethylamino)thiadiazol-4-yl]methyl]amino]-N-propan-2-ylacetamide
CID 55046373
N-ethyl-2-[ethyl-[[5-(ethylamino)thiadiazol-4-yl]methyl]amino]acetamide
CID 55046475

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione?
The IUPAC name of 5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione (CID 62207837) is 5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione?
The canonical SMILES for 5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione is CNc1snnc1CN1C(=O)NC(C)(C)C1=O.
What is the InChIKey of 5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione?
The InChIKey is ZYZUFJOLOFVRAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5O2S/c1-9(2)7(15)14(8(16)11-9)4-5-6(10-3)17-13-12-5/h10H,4H2,1-3H3,(H,11,16).
What are the key properties of 5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione?
5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione has a molecular weight of 255.30 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-3-[[5-(methylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 62207837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).