(4-amino-6-chloropyridazin-3-yl)methanol

C5H6ClN3O — CID 164907065

IUPAC(4-amino-6-chloropyridazin-3-yl)methanol
SMILESNc1cc(Cl)nnc1CO
InChIInChI=1S/C5H6ClN3O/c6-5-1-3(7)4(2-10)8-9-5/h1,10H,2H2,(H2,7,9)
InChIKeyXVGMXXGEGGBKBK-UHFFFAOYSA-N
MW159.58 g/mol
LogP0.20
Rot. Bonds1

About (4-amino-6-chloropyridazin-3-yl)methanol

(4-amino-6-chloropyridazin-3-yl)methanol (PubChem CID 164907065) has the molecular formula C5H6ClN3O and a molecular weight of 159.58 g/mol. Its IUPAC name is (4-amino-6-chloropyridazin-3-yl)methanol.

Molecular Properties

Compound Name(4-amino-6-chloropyridazin-3-yl)methanol
PubChem CID164907065
Molecular FormulaC5H6ClN3O
Molecular Weight159.58 g/mol
Exact Mass159.02
IUPAC Name(4-amino-6-chloropyridazin-3-yl)methanol
SMILESNc1cc(Cl)nnc1CO
InChIInChI=1S/C5H6ClN3O/c6-5-1-3(7)4(2-10)8-9-5/h1,10H,2H2,(H2,7,9)
InChIKeyXVGMXXGEGGBKBK-UHFFFAOYSA-N
XLogP0.20
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.58
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(6-Chloropyridazin-3-yl)methanol hydrochloride
CID 75480741
(6-Chloropyridazin-3-yl)methanol
CID 20557609
(4-Aminopyridazin-3-yl)methanol
CID 23334123
(6-Chloro-4-methylpyridazin-3-yl)methanol
CID 58717045
(6-Chloro-5-methylpyridazin-3-yl)methanol
CID 162520179
(4,6-Dichloropyridazin-3-yl)methanol
CID 164907111
[6-Chloro-4-(cyclopentylamino)pyridazin-3-yl]methanol
CID 165176193
1-(6-Chloropyridazin-3-yl)ethanol
CID 172106312
(5-Amino-6-chloropyridazin-3-yl)methanol
CID 117104929
3-Chloro-6-(methoxymethyl)pyridazin-4-amine
CID 117104933
(6-Amino-5-chloropyridazin-3-yl)methanol
CID 117104935
(5,6-Dichloropyridazin-3-yl)methanol
CID 117104937

Frequently Asked Questions

What is the IUPAC name of (4-amino-6-chloropyridazin-3-yl)methanol?
The IUPAC name of (4-amino-6-chloropyridazin-3-yl)methanol (CID 164907065) is (4-amino-6-chloropyridazin-3-yl)methanol.
What is the SMILES notation for (4-amino-6-chloropyridazin-3-yl)methanol?
The canonical SMILES for (4-amino-6-chloropyridazin-3-yl)methanol is Nc1cc(Cl)nnc1CO.
What is the InChIKey of (4-amino-6-chloropyridazin-3-yl)methanol?
The InChIKey is XVGMXXGEGGBKBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6ClN3O/c6-5-1-3(7)4(2-10)8-9-5/h1,10H,2H2,(H2,7,9).
What are the key properties of (4-amino-6-chloropyridazin-3-yl)methanol?
(4-amino-6-chloropyridazin-3-yl)methanol has a molecular weight of 159.58 g/mol, XLogP of 0.20, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-6-chloropyridazin-3-yl)methanol is sourced from PubChem (CID 164907065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).