(6-chloro-5-methylpyridazin-3-yl)methanol

C6H7ClN2O — CID 162520179

IUPAC(6-chloro-5-methylpyridazin-3-yl)methanol
SMILESCc1cc(CO)nnc1Cl
InChIInChI=1S/C6H7ClN2O/c1-4-2-5(3-10)8-9-6(4)7/h2,10H,3H2,1H3
InChIKeyUCVTVWGWJRGPGB-UHFFFAOYSA-N
MW158.59 g/mol
LogP0.93
Rot. Bonds1

About (6-chloro-5-methylpyridazin-3-yl)methanol

(6-chloro-5-methylpyridazin-3-yl)methanol (PubChem CID 162520179) has the molecular formula C6H7ClN2O and a molecular weight of 158.59 g/mol. Its IUPAC name is (6-chloro-5-methylpyridazin-3-yl)methanol.

Molecular Properties

Compound Name(6-chloro-5-methylpyridazin-3-yl)methanol
PubChem CID162520179
Molecular FormulaC6H7ClN2O
Molecular Weight158.59 g/mol
Exact Mass158.02
IUPAC Name(6-chloro-5-methylpyridazin-3-yl)methanol
SMILESCc1cc(CO)nnc1Cl
InChIInChI=1S/C6H7ClN2O/c1-4-2-5(3-10)8-9-6(4)7/h2,10H,3H2,1H3
InChIKeyUCVTVWGWJRGPGB-UHFFFAOYSA-N
XLogP0.93
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.59
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(6-Methylpyridazin-3-yl)methanol
CID 53420938
2-(6-Chloropyridazin-3-yl)propan-2-ol
CID 59526161
(6-Chloropyridazin-3-yl)methanol hydrochloride
CID 75480741
(6-Chloropyridazin-3-yl)methanol
CID 20557609
1-(6-Chloropyridazin-3-yl)-2,2,2-trifluoroethanol
CID 112757096
[4-Methyl-6-(trifluoromethyl)pyridazin-3-yl]methanol
CID 178824780
(1S)-1-(6-chloropyridazin-3-yl)-2,2,2-trifluoroethanol
CID 124676110
(1R)-1-(6-chloropyridazin-3-yl)-2,2,2-trifluoroethanol
CID 124676111
2-(3-Chloro-6-methylpyridazin-4-yl)-2-methylpropan-1-ol
CID 14349841
3-Chloro-6-methyl-4-pyridazinemethanol
CID 20557656
(3,6-Dimethylpyridazin-4-yl)methanol
CID 20557783
3-Chloro-6-(methoxymethyl)pyridazine
CID 53385516

Frequently Asked Questions

What is the IUPAC name of (6-chloro-5-methylpyridazin-3-yl)methanol?
The IUPAC name of (6-chloro-5-methylpyridazin-3-yl)methanol (CID 162520179) is (6-chloro-5-methylpyridazin-3-yl)methanol.
What is the SMILES notation for (6-chloro-5-methylpyridazin-3-yl)methanol?
The canonical SMILES for (6-chloro-5-methylpyridazin-3-yl)methanol is Cc1cc(CO)nnc1Cl.
What is the InChIKey of (6-chloro-5-methylpyridazin-3-yl)methanol?
The InChIKey is UCVTVWGWJRGPGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClN2O/c1-4-2-5(3-10)8-9-6(4)7/h2,10H,3H2,1H3.
What are the key properties of (6-chloro-5-methylpyridazin-3-yl)methanol?
(6-chloro-5-methylpyridazin-3-yl)methanol has a molecular weight of 158.59 g/mol, XLogP of 0.93, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-5-methylpyridazin-3-yl)methanol is sourced from PubChem (CID 162520179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).