5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione

C12H19N5O2S — CID 62207144

IUPAC5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione
SMILESCCCNc1snnc1CN1C(=O)NC(C)(CC)C1=O
InChIInChI=1S/C12H19N5O2S/c1-4-6-13-9-8(15-16-20-9)7-17-10(18)12(3,5-2)14-11(17)19/h13H,4-7H2,1-3H3,(H,14,19)
InChIKeySSVVYGOTTXXHRN-UHFFFAOYSA-N
MW297.38 g/mol
LogP1.58
Rot. Bonds6

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

5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione (PubChem CID 62207144) has the molecular formula C12H19N5O2S and a molecular weight of 297.38 g/mol. Its IUPAC name is 5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione
PubChem CID62207144
Molecular FormulaC12H19N5O2S
Molecular Weight297.38 g/mol
Exact Mass297.13
IUPAC Name5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione
SMILESCCCNc1snnc1CN1C(=O)NC(C)(CC)C1=O
InChIInChI=1S/C12H19N5O2S/c1-4-6-13-9-8(15-16-20-9)7-17-10(18)12(3,5-2)14-11(17)19/h13H,4-7H2,1-3H3,(H,14,19)
InChIKeySSVVYGOTTXXHRN-UHFFFAOYSA-N
XLogP1.58
TPSA87.22 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

1-Acetyl-5-isopropyl-3-(4-methyl-1,2,3-thiadiazol-5-yl)-imidazolidine-2,4-dione
CID 129875497
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
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
3-[[5-(Propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione
CID 55046622
5,5-Dimethyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione
CID 55046675
1-Methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidin-2-one
CID 55078272
2-[Methyl-[[5-(propylamino)thiadiazol-4-yl]methyl]amino]-1-pyrrolidin-1-ylethanone
CID 62181957
2-[Methyl-[[5-(methylamino)thiadiazol-4-yl]methyl]amino]-1-pyrrolidin-1-ylethanone
CID 62184214
2-[[5-(Ethylamino)thiadiazol-4-yl]methyl-methylamino]-1-pyrrolidin-1-ylethanone
CID 62184215

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione?
The IUPAC name of 5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione (CID 62207144) is 5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione?
The canonical SMILES for 5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione is CCCNc1snnc1CN1C(=O)NC(C)(CC)C1=O.
What is the InChIKey of 5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione?
The InChIKey is SSVVYGOTTXXHRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2S/c1-4-6-13-9-8(15-16-20-9)7-17-10(18)12(3,5-2)14-11(17)19/h13H,4-7H2,1-3H3,(H,14,19).
What are the key properties of 5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione?
5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione has a molecular weight of 297.38 g/mol, XLogP of 1.58, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-5-methyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 62207144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).