Piperazine-1,4-diylbis(pyridin-2-ylmethanone)

HCID 258989

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Basic information

CAS: 17433-21-5
Standard SMILES: O=C(c1ccccn1)N1CCN(C(=O)c2ccccn2)CC1
InChIKey: XJMVXWNSBCEPCJ-UHFFFAOYSA-N
Molecular formula: C16H16N4O2
Average molar mass: 296.32 g/mol
Monoisotopic mass: 296.12732577

Names & identifiers

Preferred name: Piperazine-1,4-diylbis(pyridin-2-ylmethanone)
IUPAC: [4-(pyridine-2-carbonyl)piperazin-1-yl]-pyridin-2-ylmethanone

Names & synonyms

17433-21-5piperazine-1,4-diylbis(pyridin-2-ylmethanone)DTXSID50293304RefChem:372685DTXCID202444441,4-bis(2-pyridinylcarbonyl)piperazine[4-(pyridine-2-carbonyl)piperazin-1-yl]-pyridin-2-yl-methanoneNSC88455[4-(pyridine-2-carbonyl)piperazin-1-yl]-pyridin-2-ylmethanoneNCIOpen2_005645MLS000536897SCHEMBL7943306

Show more names

CHEMBL1529204XJMVXWNSBCEPCJ-UHFFFAOYSA-NHMS2403B11NSC-88455STK865126AKOS002313405SMR000143506ST50759242

Database identifiers

CAS: 17433-21-5
PubChem CID: 258989
DTXSID: DTXSID50293304
ChEMBL: CHEMBL1529204

Properties

Computed structural properties

XLogP: 0.8
Topological polar surface area: 66.4 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 2
Heavy atoms: 22
Formal charge: 0
Complexity: 369

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