Molecular Identity
Milrinone
6-methyl-2-oxo-5-pyridin-4-yl-1H-pyridine-3-carbonitrile
PubChem CID: 4197
Milrinone is a member of the class of bipyridines that is 2-pyridone which is substituted at positions 3, 5, and 6 by cyano, pyrid-4-yl, and methyl groups, respectively. It is used (particularly intravenously, as the lactate) for the short-term management of severe heart failure. It has a role as a vasodilator agent, a cardiotonic drug, a platelet aggregation inhibitor and an EC 3.1.4.17 (3',5'-cyclic-nucleotide phosphodiesterase) inhibitor. It is a nitrile, a pyridone and a member of bipyridines.
2D Structure
Properties
C12H9N3O
Molecular Formula
211.22
Molecular Weight
g/mol
211.0746
Exact Mass
Da
0
XLogP
Drug-like (Lipinski: < 5)
65.8
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
419
Complexity
SMILES
Canonical SMILES
SMILES: CC1=C(C=C(C(=O)N1)C#N)C2=CC=NC=C2Isomeric SMILES
SMILES: CC1=C(C=C(C(=O)N1)C#N)C2=CC=NC=C2Synonyms(20)
milrinone78415-72-2MilrilaMilrinonaMilrinonumWin-47203-21,6-Dihydro-2-methyl-6-oxo(3,4'-bipyridine)-5-carbonitrileDTXSID50233246-methyl-2-oxo-5-(pyridin-4-yl)-1,2-dihydropyridine-3-carbonitrileJU9YAX04C7WIN 47203NSC-760072WIN 47,203-2(3,4'-BIPYRIDINE)-5-CARBONITRILE, 1,6-DIHYDRO-2-METHYL-6-OXO-DTXCID103324
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Milrinone
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