2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride

C8H17Cl2N5O — CID 3043956

IUPAC2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride
SMILESCCN(CCO)c1ccc(NN)nn1.Cl.Cl
InChIInChI=1S/C8H15N5O.2ClH/c1-2-13(5-6-14)8-4-3-7(10-9)11-12-8;;/h3-4,14H,2,5-6,9H2,1H3,(H,10,11);2*1H
InChIKeyDMLZRHRYZJEMQK-UHFFFAOYSA-N
MW270.16 g/mol
LogP0.42
Rot. Bonds5

About 2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride

2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride (PubChem CID 3043956) has the molecular formula C8H17Cl2N5O and a molecular weight of 270.16 g/mol. Its IUPAC name is 2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride.

Molecular Properties

Compound Name2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride
PubChem CID3043956
Molecular FormulaC8H17Cl2N5O
Molecular Weight270.16 g/mol
Exact Mass269.08
IUPAC Name2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride
SMILESCCN(CCO)c1ccc(NN)nn1.Cl.Cl
InChIInChI=1S/C8H15N5O.2ClH/c1-2-13(5-6-14)8-4-3-7(10-9)11-12-8;;/h3-4,14H,2,5-6,9H2,1H3,(H,10,11);2*1H
InChIKeyDMLZRHRYZJEMQK-UHFFFAOYSA-N
XLogP0.42
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.16
LogP ≤ 50.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride?
The IUPAC name of 2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride (CID 3043956) is 2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride.
What is the SMILES notation for 2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride?
The canonical SMILES for 2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride is CCN(CCO)c1ccc(NN)nn1.Cl.Cl.
What is the InChIKey of 2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride?
The InChIKey is DMLZRHRYZJEMQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5O.2ClH/c1-2-13(5-6-14)8-4-3-7(10-9)11-12-8;;/h3-4,14H,2,5-6,9H2,1H3,(H,10,11);2*1H.
What are the key properties of 2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride?
2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride has a molecular weight of 270.16 g/mol, XLogP of 0.42, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(6-hydrazinylpyridazin-3-yl)amino]ethanol;dihydrochloride is sourced from PubChem (CID 3043956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).