(4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone

C19H21N7O — CID 143176023

IUPAC(4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone
SMILESCc1ccc(-n2nc(C(=O)N3CCN(C)CC3)cc2-c2ccccn2)nn1
InChIInChI=1S/C19H21N7O/c1-14-6-7-18(22-21-14)26-17(15-5-3-4-8-20-15)13-16(23-26)19(27)25-11-9-24(2)10-12-25/h3-8,13H,9-12H2,1-2H3
InChIKeyYFDVKPSIDQKQSP-UHFFFAOYSA-N
MW363.43 g/mol
LogP1.42
Rot. Bonds3

About (4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone

(4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone (PubChem CID 143176023) has the molecular formula C19H21N7O and a molecular weight of 363.43 g/mol. Its IUPAC name is (4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone.

Molecular Properties

Compound Name(4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone
PubChem CID143176023
Molecular FormulaC19H21N7O
Molecular Weight363.43 g/mol
Exact Mass363.18
IUPAC Name(4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone
SMILESCc1ccc(-n2nc(C(=O)N3CCN(C)CC3)cc2-c2ccccn2)nn1
InChIInChI=1S/C19H21N7O/c1-14-6-7-18(22-21-14)26-17(15-5-3-4-8-20-15)13-16(23-26)19(27)25-11-9-24(2)10-12-25/h3-8,13H,9-12H2,1-2H3
InChIKeyYFDVKPSIDQKQSP-UHFFFAOYSA-N
XLogP1.42
TPSA80.04 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.43
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze (4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4-fluoropiperidin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone
CID 70858729
1-(6-chloropyridazin-3-yl)-5-pyridin-2-ylpyrazole-3-carboxylic acid
CID 23090192
methyl 1-(6-chloropyridazin-3-yl)-5-pyridin-2-ylpyrazole-3-carboxylate
CID 23143755
2-(4-methylpiperazine-1-carbonyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
CID 175852598
[4-[2-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl]-pyridin-2-ylmethanone
CID 122340982
[1-(6-methoxy-3-pyridinyl)-5-pyridin-2-ylpyrazol-3-yl]-morpholin-4-ylmethanone
CID 23090523
(4-aminopiperidin-1-yl)-[5-pyridin-2-yl-1-(3,4,5-trifluorophenyl)pyrazol-3-yl]methanone
CID 118215079
(7-ethyl-2-pyridin-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-(4-methylpiperazin-1-yl)methanone
CID 53040574
(1,5-dimethylpyrazol-3-yl)-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 44757097
(4-methylpiperazin-1-yl)-[3-(4-pyridin-2-ylpiperazine-1-carbonyl)phenyl]methanone
CID 109053532
5-(5-methyl-2-pyridinyl)-1-pyridin-2-ylpyrazole-3-carboxylic acid
CID 23143661
[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]-pyridin-2-ylmethanone
CID 55652947

Frequently Asked Questions

What is the IUPAC name of (4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone?
The IUPAC name of (4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone (CID 143176023) is (4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone.
What is the SMILES notation for (4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone?
The canonical SMILES for (4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone is Cc1ccc(-n2nc(C(=O)N3CCN(C)CC3)cc2-c2ccccn2)nn1.
What is the InChIKey of (4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone?
The InChIKey is YFDVKPSIDQKQSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N7O/c1-14-6-7-18(22-21-14)26-17(15-5-3-4-8-20-15)13-16(23-26)19(27)25-11-9-24(2)10-12-25/h3-8,13H,9-12H2,1-2H3.
What are the key properties of (4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone?
(4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone has a molecular weight of 363.43 g/mol, XLogP of 1.42, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylpiperazin-1-yl)-[1-(6-methylpyridazin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]methanone is sourced from PubChem (CID 143176023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).