4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione

C11H16N6O2 — CID 80921870

IUPAC4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione
SMILESCc1cc(N2CC(=O)NC(=O)C2(C)C)nc(NN)n1
InChIInChI=1S/C11H16N6O2/c1-6-4-7(14-10(13-6)16-12)17-5-8(18)15-9(19)11(17,2)3/h4H,5,12H2,1-3H3,(H,13,14,16)(H,15,18,19)
InChIKeyGCULPJNAASNXRW-UHFFFAOYSA-N
MW264.29 g/mol
LogP-0.69
Rot. Bonds2

About 4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione

4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione (PubChem CID 80921870) has the molecular formula C11H16N6O2 and a molecular weight of 264.29 g/mol. Its IUPAC name is 4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione.

Molecular Properties

Compound Name4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione
PubChem CID80921870
Molecular FormulaC11H16N6O2
Molecular Weight264.29 g/mol
Exact Mass264.13
IUPAC Name4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione
SMILESCc1cc(N2CC(=O)NC(=O)C2(C)C)nc(NN)n1
InChIInChI=1S/C11H16N6O2/c1-6-4-7(14-10(13-6)16-12)17-5-8(18)15-9(19)11(17,2)3/h4H,5,12H2,1-3H3,(H,13,14,16)(H,15,18,19)
InChIKeyGCULPJNAASNXRW-UHFFFAOYSA-N
XLogP-0.69
TPSA113.24 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 5-0.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione?
The IUPAC name of 4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione (CID 80921870) is 4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione.
What is the SMILES notation for 4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione?
The canonical SMILES for 4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione is Cc1cc(N2CC(=O)NC(=O)C2(C)C)nc(NN)n1.
What is the InChIKey of 4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione?
The InChIKey is GCULPJNAASNXRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6O2/c1-6-4-7(14-10(13-6)16-12)17-5-8(18)15-9(19)11(17,2)3/h4H,5,12H2,1-3H3,(H,13,14,16)(H,15,18,19).
What are the key properties of 4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione?
4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione has a molecular weight of 264.29 g/mol, XLogP of -0.69, 2 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydrazinyl-6-methylpyrimidin-4-yl)-3,3-dimethylpiperazine-2,6-dione is sourced from PubChem (CID 80921870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).