pyridazine-3-carboximidamide;hydrochloride

C5H7ClN4 — CID 18756080

IUPACpyridazine-3-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1cccnn1
InChIInChI=1S/C5H6N4.ClH/c6-5(7)4-2-1-3-8-9-4;/h1-3H,(H3,6,7);1H
InChIKeyKTOMCOIENXYOGJ-UHFFFAOYSA-N
MW158.59 g/mol
LogP0.18
Rot. Bonds1

About pyridazine-3-carboximidamide;hydrochloride

pyridazine-3-carboximidamide;hydrochloride (PubChem CID 18756080) has the molecular formula C5H7ClN4 and a molecular weight of 158.59 g/mol. Its IUPAC name is pyridazine-3-carboximidamide;hydrochloride.

Molecular Properties

Compound Namepyridazine-3-carboximidamide;hydrochloride
PubChem CID18756080
Molecular FormulaC5H7ClN4
Molecular Weight158.59 g/mol
Exact Mass158.04
IUPAC Namepyridazine-3-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1cccnn1
InChIInChI=1S/C5H6N4.ClH/c6-5(7)4-2-1-3-8-9-4;/h1-3H,(H3,6,7);1H
InChIKeyKTOMCOIENXYOGJ-UHFFFAOYSA-N
XLogP0.18
TPSA75.65 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.59
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of pyridazine-3-carboximidamide;hydrochloride?
The IUPAC name of pyridazine-3-carboximidamide;hydrochloride (CID 18756080) is pyridazine-3-carboximidamide;hydrochloride.
What is the SMILES notation for pyridazine-3-carboximidamide;hydrochloride?
The canonical SMILES for pyridazine-3-carboximidamide;hydrochloride is Cl.[H]/N=C(\N)c1cccnn1.
What is the InChIKey of pyridazine-3-carboximidamide;hydrochloride?
The InChIKey is KTOMCOIENXYOGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N4.ClH/c6-5(7)4-2-1-3-8-9-4;/h1-3H,(H3,6,7);1H.
What are the key properties of pyridazine-3-carboximidamide;hydrochloride?
pyridazine-3-carboximidamide;hydrochloride has a molecular weight of 158.59 g/mol, XLogP of 0.18, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyridazine-3-carboximidamide;hydrochloride is sourced from PubChem (CID 18756080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).