4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione

C11H13N5O3 — CID 66076054

IUPAC4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione
SMILESCC1C(=O)NC(=O)CN1C(=O)c1cc(NN)ccn1
InChIInChI=1S/C11H13N5O3/c1-6-10(18)14-9(17)5-16(6)11(19)8-4-7(15-12)2-3-13-8/h2-4,6H,5,12H2,1H3,(H,13,15)(H,14,17,18)
InChIKeyBXTFANAKJXOLCP-UHFFFAOYSA-N
MW263.26 g/mol
LogP-1.15
Rot. Bonds2

About 4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione

4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione (PubChem CID 66076054) has the molecular formula C11H13N5O3 and a molecular weight of 263.26 g/mol. Its IUPAC name is 4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione.

Molecular Properties

Compound Name4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione
PubChem CID66076054
Molecular FormulaC11H13N5O3
Molecular Weight263.26 g/mol
Exact Mass263.10
IUPAC Name4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione
SMILESCC1C(=O)NC(=O)CN1C(=O)c1cc(NN)ccn1
InChIInChI=1S/C11H13N5O3/c1-6-10(18)14-9(17)5-16(6)11(19)8-4-7(15-12)2-3-13-8/h2-4,6H,5,12H2,1H3,(H,13,15)(H,14,17,18)
InChIKeyBXTFANAKJXOLCP-UHFFFAOYSA-N
XLogP-1.15
TPSA117.42 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.26
LogP ≤ 5-1.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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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Related Compounds

3-ethyl-4-(4-hydrazinylpyridine-2-carbonyl)piperazine-2,6-dione
CID 66067262
3-methyl-4-(pyrazine-2-carbonyl)piperazine-2,6-dione
CID 66060995
4-(5-bromopyridine-2-carbonyl)-3-methylpiperazine-2,6-dione
CID 66061183
4-(4-hydrazinyl-3-methylbenzoyl)-3-methylpiperazine-2,6-dione
CID 66076244
4-(2-amino-3-fluoropyridine-4-carbonyl)-3-methylpiperazine-2,6-dione
CID 105386764
3-methyl-4-(1-methylimidazole-4-carbonyl)piperazine-2,6-dione
CID 107973133
4-(4-amino-3-methylbenzoyl)-3-methylpiperazine-2,6-dione
CID 66061873
4-(4-hydrazinylpyridine-2-carbonyl)-3,3-dimethylpiperazin-2-one
CID 63600752
2-methyl-3,5-dioxopiperazine-1-carbohydrazide
CID 66074885
2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl-(4-hydrazinyl-2-pyridinyl)methanone
CID 65322440
2-methyl-6-(2-methyl-3,5-dioxopiperazine-1-carbonyl)pyridine-3-carbonitrile
CID 66062893
3-methyl-4-[4-(methylamino)pyridine-3-carbonyl]piperazine-2,6-dione
CID 81244952

Frequently Asked Questions

What is the IUPAC name of 4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione?
The IUPAC name of 4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione (CID 66076054) is 4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione.
What is the SMILES notation for 4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione?
The canonical SMILES for 4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione is CC1C(=O)NC(=O)CN1C(=O)c1cc(NN)ccn1.
What is the InChIKey of 4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione?
The InChIKey is BXTFANAKJXOLCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O3/c1-6-10(18)14-9(17)5-16(6)11(19)8-4-7(15-12)2-3-13-8/h2-4,6H,5,12H2,1H3,(H,13,15)(H,14,17,18).
What are the key properties of 4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione?
4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione has a molecular weight of 263.26 g/mol, XLogP of -1.15, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydrazinylpyridine-2-carbonyl)-3-methylpiperazine-2,6-dione is sourced from PubChem (CID 66076054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).