(6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone

C12H15N7OS — CID 62233763

IUPAC(6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
SMILESNNc1ccc(C(=O)N2CCN(c3nccs3)CC2)nn1
InChIInChI=1S/C12H15N7OS/c13-15-10-2-1-9(16-17-10)11(20)18-4-6-19(7-5-18)12-14-3-8-21-12/h1-3,8H,4-7,13H2,(H,15,17)
InChIKeyOKTOBBTWVLHZNQ-UHFFFAOYSA-N
MW305.37 g/mol
LogP0.18
Rot. Bonds3

About (6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone

(6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone (PubChem CID 62233763) has the molecular formula C12H15N7OS and a molecular weight of 305.37 g/mol. Its IUPAC name is (6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name(6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
PubChem CID62233763
Molecular FormulaC12H15N7OS
Molecular Weight305.37 g/mol
Exact Mass305.11
IUPAC Name(6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
SMILESNNc1ccc(C(=O)N2CCN(c3nccs3)CC2)nn1
InChIInChI=1S/C12H15N7OS/c13-15-10-2-1-9(16-17-10)11(20)18-4-6-19(7-5-18)12-14-3-8-21-12/h1-3,8H,4-7,13H2,(H,15,17)
InChIKeyOKTOBBTWVLHZNQ-UHFFFAOYSA-N
XLogP0.18
TPSA100.27 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.37
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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

(6-chloropyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
CID 60858865
(3-hydrazinyl-4-pyridinyl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
CID 105071524
6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-hydrazinylpyridazin-3-yl)methanone
CID 62249906
(3-amino-2-pyridinyl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
CID 104740876
(2,6-dihydroxyphenyl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
CID 103748970
1,3-thiazol-5-yl-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
CID 73439229
5-[4-(1,3-thiazol-2-yl)piperazine-1-carbonyl]thiophene-2-carboxylic acid
CID 43414558
(6-chloropyrazin-2-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
CID 103186918
(6-hydrazinylpyridazin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone
CID 103502396
6-hydrazinyl-N-(1,3-thiazol-2-yl)pyridazine-3-carboxamide
CID 62237920
N-(4-aminophenyl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 43468985
(5-bromo-2-hydroxyphenyl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
CID 41433639

Frequently Asked Questions

What is the IUPAC name of (6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone?
The IUPAC name of (6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone (CID 62233763) is (6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone.
What is the SMILES notation for (6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone?
The canonical SMILES for (6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone is NNc1ccc(C(=O)N2CCN(c3nccs3)CC2)nn1.
What is the InChIKey of (6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone?
The InChIKey is OKTOBBTWVLHZNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N7OS/c13-15-10-2-1-9(16-17-10)11(20)18-4-6-19(7-5-18)12-14-3-8-21-12/h1-3,8H,4-7,13H2,(H,15,17).
What are the key properties of (6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone?
(6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone has a molecular weight of 305.37 g/mol, XLogP of 0.18, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (6-hydrazinylpyridazin-3-yl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 62233763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).