3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one

C13H19N5O2 — CID 81249127

IUPAC3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one
SMILESCCC1C(=O)NCCN1C(=O)c1cnc(C)cc1NN
InChIInChI=1S/C13H19N5O2/c1-3-11-12(19)15-4-5-18(11)13(20)9-7-16-8(2)6-10(9)17-14/h6-7,11H,3-5,14H2,1-2H3,(H,15,19)(H,16,17)
InChIKeyIZGBPTIBRYVVAZ-UHFFFAOYSA-N
MW277.33 g/mol
LogP0.03
Rot. Bonds3

About 3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one

3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one (PubChem CID 81249127) has the molecular formula C13H19N5O2 and a molecular weight of 277.33 g/mol. Its IUPAC name is 3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one.

Molecular Properties

Compound Name3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one
PubChem CID81249127
Molecular FormulaC13H19N5O2
Molecular Weight277.33 g/mol
Exact Mass277.15
IUPAC Name3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one
SMILESCCC1C(=O)NCCN1C(=O)c1cnc(C)cc1NN
InChIInChI=1S/C13H19N5O2/c1-3-11-12(19)15-4-5-18(11)13(20)9-7-16-8(2)6-10(9)17-14/h6-7,11H,3-5,14H2,1-2H3,(H,15,19)(H,16,17)
InChIKeyIZGBPTIBRYVVAZ-UHFFFAOYSA-N
XLogP0.03
TPSA100.35 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 50.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-ethyl-4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)piperazin-2-one
CID 105388347
3-ethyl-4-[5-methyl-2-(methylamino)benzoyl]piperazin-2-one
CID 63604617
4-(2,5-dimethylthiophene-3-carbonyl)-3-ethylpiperazin-2-one
CID 63601701
3-ethyl-4-(2-methylbenzoyl)piperazin-2-one
CID 63601884
4-(5-bromo-2-chloropyridine-3-carbonyl)-3-ethylpiperazin-2-one
CID 63601394
(3,4-dihydroxypyrrolidin-1-yl)-(4-hydrazinyl-6-methyl-3-pyridinyl)methanone
CID 106673912
3-ethyl-4-[2-(methylamino)benzoyl]piperazin-2-one
CID 63604913
4-(2,4-dibromobenzoyl)-3-ethylpiperazin-2-one
CID 103882803
4-(2-chloro-5-sulfanylbenzoyl)-3-ethylpiperazin-2-one
CID 107029813
4-(4-amino-6-methylpyridine-3-carbonyl)-3-methylpiperazin-2-one
CID 81241204
4-(4-amino-6-methylpyridine-3-carbonyl)-3-ethylpiperazine-2,6-dione
CID 81245392
3-ethyl-4-(6-hydrazinylpyridine-2-carbonyl)piperazin-2-one
CID 63603750

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one?
The IUPAC name of 3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one (CID 81249127) is 3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one.
What is the SMILES notation for 3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one?
The canonical SMILES for 3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one is CCC1C(=O)NCCN1C(=O)c1cnc(C)cc1NN.
What is the InChIKey of 3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one?
The InChIKey is IZGBPTIBRYVVAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O2/c1-3-11-12(19)15-4-5-18(11)13(20)9-7-16-8(2)6-10(9)17-14/h6-7,11H,3-5,14H2,1-2H3,(H,15,19)(H,16,17).
What are the key properties of 3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one?
3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one has a molecular weight of 277.33 g/mol, XLogP of 0.03, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-(4-hydrazinyl-6-methylpyridine-3-carbonyl)piperazin-2-one is sourced from PubChem (CID 81249127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).