5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione

C13H19N5O2 — CID 103057107

IUPAC5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione
SMILESCCNc1cnc(CN2C(=O)NC(C)(CC)C2=O)cn1
InChIInChI=1S/C13H19N5O2/c1-4-13(3)11(19)18(12(20)17-13)8-9-6-16-10(7-15-9)14-5-2/h6-7H,4-5,8H2,1-3H3,(H,14,16)(H,17,20)
InChIKeyKJIYZBJNCICDPC-UHFFFAOYSA-N
MW277.33 g/mol
LogP1.13
Rot. Bonds5

About 5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione

5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione (PubChem CID 103057107) has the molecular formula C13H19N5O2 and a molecular weight of 277.33 g/mol. Its IUPAC name is 5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione
PubChem CID103057107
Molecular FormulaC13H19N5O2
Molecular Weight277.33 g/mol
Exact Mass277.15
IUPAC Name5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione
SMILESCCNc1cnc(CN2C(=O)NC(C)(CC)C2=O)cn1
InChIInChI=1S/C13H19N5O2/c1-4-13(3)11(19)18(12(20)17-13)8-9-6-16-10(7-15-9)14-5-2/h6-7H,4-5,8H2,1-3H3,(H,14,16)(H,17,20)
InChIKeyKJIYZBJNCICDPC-UHFFFAOYSA-N
XLogP1.13
TPSA87.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

5-ethyl-3-[[6-(ethylamino)-3-pyridinyl]methyl]-5-methylimidazolidine-2,4-dione
CID 62207321
2-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[c]pyrrole-1,3-dione
CID 103057808
1-[[5-(ethylamino)pyrazin-2-yl]methyl]-4-propylpiperazine-2,5-dione
CID 103057509
3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione
CID 103061507
2-[[5-(ethylamino)pyrazin-2-yl]methyl]-4,5-dimethyl-1H-pyridazine-3,6-dione
CID 103057319
5-ethyl-1-[[5-(ethylamino)pyrazin-2-yl]methyl]pyrimidine-2,4-dione
CID 103057470
3-[3-[(5-chloro-2-pyridinyl)amino]propyl]-5-ethyl-5-methylimidazolidine-2,4-dione
CID 75374277
N-ethyl-5-(piperidin-1-ylmethyl)pyrazin-2-amine
CID 103055450
1-[[5-(ethylamino)pyrazin-2-yl]methyl]-4-methylpiperazine-2,3-dione
CID 103057285
3-[[2-(ethylamino)-1,3-thiazol-5-yl]methyl]-5,5-dimethylimidazolidine-2,4-dione
CID 79775113
3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-iodopyrimidin-4-one
CID 103057459
4-[[5-(ethylamino)pyrazin-2-yl]methyl]-1-methylpiperazin-2-one
CID 103056548

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione?
The IUPAC name of 5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione (CID 103057107) is 5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione.
What is the SMILES notation for 5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione?
The canonical SMILES for 5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione is CCNc1cnc(CN2C(=O)NC(C)(CC)C2=O)cn1.
What is the InChIKey of 5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione?
The InChIKey is KJIYZBJNCICDPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O2/c1-4-13(3)11(19)18(12(20)17-13)8-9-6-16-10(7-15-9)14-5-2/h6-7H,4-5,8H2,1-3H3,(H,14,16)(H,17,20).
What are the key properties of 5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione?
5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione has a molecular weight of 277.33 g/mol, XLogP of 1.13, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione is sourced from PubChem (CID 103057107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).