(6-amino-5-bromopyridazin-3-yl)methanol

C5H6BrN3O — CID 117104943

IUPAC(6-amino-5-bromopyridazin-3-yl)methanol
SMILESNc1nnc(CO)cc1Br
InChIInChI=1S/C5H6BrN3O/c6-4-1-3(2-10)8-9-5(4)7/h1,10H,2H2,(H2,7,9)
InChIKeyQVYDXCGFPWNTSW-UHFFFAOYSA-N
MW204.03 g/mol
LogP0.31
Rot. Bonds1

About (6-amino-5-bromopyridazin-3-yl)methanol

(6-amino-5-bromopyridazin-3-yl)methanol (PubChem CID 117104943) has the molecular formula C5H6BrN3O and a molecular weight of 204.03 g/mol. Its IUPAC name is (6-amino-5-bromopyridazin-3-yl)methanol.

Molecular Properties

Compound Name(6-amino-5-bromopyridazin-3-yl)methanol
PubChem CID117104943
Molecular FormulaC5H6BrN3O
Molecular Weight204.03 g/mol
Exact Mass202.97
IUPAC Name(6-amino-5-bromopyridazin-3-yl)methanol
SMILESNc1nnc(CO)cc1Br
InChIInChI=1S/C5H6BrN3O/c6-4-1-3(2-10)8-9-5(4)7/h1,10H,2H2,(H2,7,9)
InChIKeyQVYDXCGFPWNTSW-UHFFFAOYSA-N
XLogP0.31
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.03
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(6-Aminopyridazin-3-yl)methanol hydrochloride
CID 126797015
(6-Aminopyridazin-3-yl)methanol
CID 20557894
[6-Amino-4-(trifluoromethyl)pyridazin-3-yl]methanol
CID 170598629
1-(6-Aminopyridazin-3-yl)ethenol
CID 118425956
(6-Bromo-5-methylpyridazin-3-YL)methanol
CID 156497763
(5,6-Diaminopyridazin-3-yl)methanol
CID 117104927
(6-Amino-5-chloropyridazin-3-yl)methanol
CID 117104935
(5-Bromopyridazin-3-yl)methanol
CID 117104942
(5-Bromo-6-chloropyridazin-3-yl)methanol
CID 117104945
4-Bromo-6-(methoxymethyl)pyridazin-3-amine
CID 117104947
2-(6-Amino-5-bromopyridazin-3-yl)ethanol
CID 117104979
4-Bromo-6-(2-methoxyethyl)pyridazin-3-amine
CID 117104983

Frequently Asked Questions

What is the IUPAC name of (6-amino-5-bromopyridazin-3-yl)methanol?
The IUPAC name of (6-amino-5-bromopyridazin-3-yl)methanol (CID 117104943) is (6-amino-5-bromopyridazin-3-yl)methanol.
What is the SMILES notation for (6-amino-5-bromopyridazin-3-yl)methanol?
The canonical SMILES for (6-amino-5-bromopyridazin-3-yl)methanol is Nc1nnc(CO)cc1Br.
What is the InChIKey of (6-amino-5-bromopyridazin-3-yl)methanol?
The InChIKey is QVYDXCGFPWNTSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6BrN3O/c6-4-1-3(2-10)8-9-5(4)7/h1,10H,2H2,(H2,7,9).
What are the key properties of (6-amino-5-bromopyridazin-3-yl)methanol?
(6-amino-5-bromopyridazin-3-yl)methanol has a molecular weight of 204.03 g/mol, XLogP of 0.31, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-amino-5-bromopyridazin-3-yl)methanol is sourced from PubChem (CID 117104943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).