4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one

C11H14FN5O2 — CID 105388346

IUPAC4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one
SMILESCC1C(=O)NCCN1C(=O)c1ccnc(NN)c1F
InChIInChI=1S/C11H14FN5O2/c1-6-10(18)15-4-5-17(6)11(19)7-2-3-14-9(16-13)8(7)12/h2-3,6H,4-5,13H2,1H3,(H,14,16)(H,15,18)
InChIKeyOIAQSVKMWPCFAN-UHFFFAOYSA-N
MW267.26 g/mol
LogP-0.53
Rot. Bonds2

About 4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one

4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one (PubChem CID 105388346) has the molecular formula C11H14FN5O2 and a molecular weight of 267.26 g/mol. Its IUPAC name is 4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one.

Molecular Properties

Compound Name4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one
PubChem CID105388346
Molecular FormulaC11H14FN5O2
Molecular Weight267.26 g/mol
Exact Mass267.11
IUPAC Name4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one
SMILESCC1C(=O)NCCN1C(=O)c1ccnc(NN)c1F
InChIInChI=1S/C11H14FN5O2/c1-6-10(18)15-4-5-17(6)11(19)7-2-3-14-9(16-13)8(7)12/h2-3,6H,4-5,13H2,1H3,(H,14,16)(H,15,18)
InChIKeyOIAQSVKMWPCFAN-UHFFFAOYSA-N
XLogP-0.53
TPSA100.35 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.26
LogP ≤ 5-0.53
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
4-(2,3-difluorobenzoyl)-3-methylpiperazin-2-one
CID 63373788
4-(2-fluoropyridine-4-carbonyl)-3-methylpiperazin-2-one
CID 55219534
2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl-(3-fluoro-2-hydrazinyl-4-pyridinyl)methanone
CID 105388424
4-(4-amino-2-fluorobenzoyl)-3-methylpiperazin-2-one
CID 63596987
5-(2-methyl-3-oxopiperazine-1-carbonyl)pyrazine-2-carboxylic acid
CID 120685364
3-methyl-4-[2-(propylamino)pyridine-3-carbonyl]piperazin-2-one
CID 63602847
(3-fluoro-2-hydrazinyl-4-pyridinyl)-(4-hydroxypiperidin-1-yl)methanone
CID 105388111
(4,4-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinyl-4-pyridinyl)methanone
CID 105388301
3-methyl-4-(2-methylfuran-3-carbonyl)piperazin-2-one
CID 63373484
4-(1-aminoisoquinoline-4-carbonyl)-3-methylpiperazin-2-one
CID 106771878
(3S)-4-(2-chlorobenzoyl)-3-methylpiperazin-2-one
CID 25283883

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one?
The IUPAC name of 4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one (CID 105388346) is 4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one.
What is the SMILES notation for 4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one?
The canonical SMILES for 4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one is CC1C(=O)NCCN1C(=O)c1ccnc(NN)c1F.
What is the InChIKey of 4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one?
The InChIKey is OIAQSVKMWPCFAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN5O2/c1-6-10(18)15-4-5-17(6)11(19)7-2-3-14-9(16-13)8(7)12/h2-3,6H,4-5,13H2,1H3,(H,14,16)(H,15,18).
What are the key properties of 4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one?
4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one has a molecular weight of 267.26 g/mol, XLogP of -0.53, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluoro-2-hydrazinylpyridine-4-carbonyl)-3-methylpiperazin-2-one is sourced from PubChem (CID 105388346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).