1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione

C10H14N6O2 — CID 103061454

IUPAC1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione
SMILESCN1CCN(Cc2cnc(NN)cn2)C(=O)C1=O
InChIInChI=1S/C10H14N6O2/c1-15-2-3-16(10(18)9(15)17)6-7-4-13-8(14-11)5-12-7/h4-5H,2-3,6,11H2,1H3,(H,13,14)
InChIKeyCBQLHYWIAJJQTL-UHFFFAOYSA-N
MW250.26 g/mol
LogP-1.44
Rot. Bonds3

About 1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione

1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione (PubChem CID 103061454) has the molecular formula C10H14N6O2 and a molecular weight of 250.26 g/mol. Its IUPAC name is 1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione.

Molecular Properties

Compound Name1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione
PubChem CID103061454
Molecular FormulaC10H14N6O2
Molecular Weight250.26 g/mol
Exact Mass250.12
IUPAC Name1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione
SMILESCN1CCN(Cc2cnc(NN)cn2)C(=O)C1=O
InChIInChI=1S/C10H14N6O2/c1-15-2-3-16(10(18)9(15)17)6-7-4-13-8(14-11)5-12-7/h4-5H,2-3,6,11H2,1H3,(H,13,14)
InChIKeyCBQLHYWIAJJQTL-UHFFFAOYSA-N
XLogP-1.44
TPSA104.45 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.26
LogP ≤ 5-1.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione?
The IUPAC name of 1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione (CID 103061454) is 1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione.
What is the SMILES notation for 1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione?
The canonical SMILES for 1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione is CN1CCN(Cc2cnc(NN)cn2)C(=O)C1=O.
What is the InChIKey of 1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione?
The InChIKey is CBQLHYWIAJJQTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O2/c1-15-2-3-16(10(18)9(15)17)6-7-4-13-8(14-11)5-12-7/h4-5H,2-3,6,11H2,1H3,(H,13,14).
What are the key properties of 1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione?
1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione has a molecular weight of 250.26 g/mol, XLogP of -1.44, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione is sourced from PubChem (CID 103061454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).