5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione

C15H21N5O2 — CID 154799872

IUPAC5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione
SMILESCc1cnc(C)c(N2CCC(C3(C)NC(=O)NC3=O)CC2)n1
InChIInChI=1S/C15H21N5O2/c1-9-8-16-10(2)12(17-9)20-6-4-11(5-7-20)15(3)13(21)18-14(22)19-15/h8,11H,4-7H2,1-3H3,(H2,18,19,21,22)
InChIKeyJOADYDRKISBJBC-UHFFFAOYSA-N
MW303.37 g/mol
LogP0.91
Rot. Bonds2

About 5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione

5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione (PubChem CID 154799872) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is 5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione
PubChem CID154799872
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC Name5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione
SMILESCc1cnc(C)c(N2CCC(C3(C)NC(=O)NC3=O)CC2)n1
InChIInChI=1S/C15H21N5O2/c1-9-8-16-10(2)12(17-9)20-6-4-11(5-7-20)15(3)13(21)18-14(22)19-15/h8,11H,4-7H2,1-3H3,(H2,18,19,21,22)
InChIKeyJOADYDRKISBJBC-UHFFFAOYSA-N
XLogP0.91
TPSA87.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione?
The IUPAC name of 5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione (CID 154799872) is 5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione.
What is the SMILES notation for 5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione?
The canonical SMILES for 5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione is Cc1cnc(C)c(N2CCC(C3(C)NC(=O)NC3=O)CC2)n1.
What is the InChIKey of 5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione?
The InChIKey is JOADYDRKISBJBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-9-8-16-10(2)12(17-9)20-6-4-11(5-7-20)15(3)13(21)18-14(22)19-15/h8,11H,4-7H2,1-3H3,(H2,18,19,21,22).
What are the key properties of 5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione?
5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione has a molecular weight of 303.37 g/mol, XLogP of 0.91, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(3,6-dimethylpyrazin-2-yl)piperidin-4-yl]-5-methylimidazolidine-2,4-dione is sourced from PubChem (CID 154799872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).