[3-(methylamino)pyridazin-4-yl]methanol;hydrochloride

C6H10ClN3O — CID 162306918

IUPAC[3-(methylamino)pyridazin-4-yl]methanol;hydrochloride
SMILESCNc1nnccc1CO.Cl
InChIInChI=1S/C6H9N3O.ClH/c1-7-6-5(4-10)2-3-8-9-6;/h2-3,10H,4H2,1H3,(H,7,9);1H
InChIKeyDSANRHVSUCXHOP-UHFFFAOYSA-N
MW175.62 g/mol
LogP0.43
Rot. Bonds2

About [3-(methylamino)pyridazin-4-yl]methanol;hydrochloride

[3-(methylamino)pyridazin-4-yl]methanol;hydrochloride (PubChem CID 162306918) has the molecular formula C6H10ClN3O and a molecular weight of 175.62 g/mol. Its IUPAC name is [3-(methylamino)pyridazin-4-yl]methanol;hydrochloride.

Molecular Properties

Compound Name[3-(methylamino)pyridazin-4-yl]methanol;hydrochloride
PubChem CID162306918
Molecular FormulaC6H10ClN3O
Molecular Weight175.62 g/mol
Exact Mass175.05
IUPAC Name[3-(methylamino)pyridazin-4-yl]methanol;hydrochloride
SMILESCNc1nnccc1CO.Cl
InChIInChI=1S/C6H9N3O.ClH/c1-7-6-5(4-10)2-3-8-9-6;/h2-3,10H,4H2,1H3,(H,7,9);1H
InChIKeyDSANRHVSUCXHOP-UHFFFAOYSA-N
XLogP0.43
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.62
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(methylamino)pyridazin-4-yl]methanol;hydrochloride?
The IUPAC name of [3-(methylamino)pyridazin-4-yl]methanol;hydrochloride (CID 162306918) is [3-(methylamino)pyridazin-4-yl]methanol;hydrochloride.
What is the SMILES notation for [3-(methylamino)pyridazin-4-yl]methanol;hydrochloride?
The canonical SMILES for [3-(methylamino)pyridazin-4-yl]methanol;hydrochloride is CNc1nnccc1CO.Cl.
What is the InChIKey of [3-(methylamino)pyridazin-4-yl]methanol;hydrochloride?
The InChIKey is DSANRHVSUCXHOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O.ClH/c1-7-6-5(4-10)2-3-8-9-6;/h2-3,10H,4H2,1H3,(H,7,9);1H.
What are the key properties of [3-(methylamino)pyridazin-4-yl]methanol;hydrochloride?
[3-(methylamino)pyridazin-4-yl]methanol;hydrochloride has a molecular weight of 175.62 g/mol, XLogP of 0.43, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(methylamino)pyridazin-4-yl]methanol;hydrochloride is sourced from PubChem (CID 162306918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).