pyridazin-4-yl(thiophen-2-yl)methanol

C9H8N2OS — CID 105079898

IUPACpyridazin-4-yl(thiophen-2-yl)methanol
SMILESOC(c1ccnnc1)c1cccs1
InChIInChI=1S/C9H8N2OS/c12-9(8-2-1-5-13-8)7-3-4-10-11-6-7/h1-6,9,12H
InChIKeyTWBMOIJQZDPZAB-UHFFFAOYSA-N
MW192.24 g/mol
LogP1.62
Rot. Bonds2

About pyridazin-4-yl(thiophen-2-yl)methanol

pyridazin-4-yl(thiophen-2-yl)methanol (PubChem CID 105079898) has the molecular formula C9H8N2OS and a molecular weight of 192.24 g/mol. Its IUPAC name is pyridazin-4-yl(thiophen-2-yl)methanol.

Molecular Properties

Compound Namepyridazin-4-yl(thiophen-2-yl)methanol
PubChem CID105079898
Molecular FormulaC9H8N2OS
Molecular Weight192.24 g/mol
Exact Mass192.04
IUPAC Namepyridazin-4-yl(thiophen-2-yl)methanol
SMILESOC(c1ccnnc1)c1cccs1
InChIInChI=1S/C9H8N2OS/c12-9(8-2-1-5-13-8)7-3-4-10-11-6-7/h1-6,9,12H
InChIKeyTWBMOIJQZDPZAB-UHFFFAOYSA-N
XLogP1.62
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-Methylthiophen-3-yl)-pyridazin-4-ylmethanol
CID 102842267
(3-Ethyl-6-methylpyridazin-4-yl)-(2-methylthiophen-3-yl)methanol
CID 102842438
(3,6-Dimethylpyridazin-4-yl)-(2-methylthiophen-3-yl)methanol
CID 102842472
(3,6-Dimethylpyridazin-4-yl)-thiophen-2-ylmethanol
CID 105079918
(3-Ethyl-6-methylpyridazin-4-yl)-thiophen-2-ylmethanol
CID 105079947
2-(1-Benzothiophen-3-yl)-1-pyridazin-4-ylethanol
CID 105083241
1-Pyridazin-4-yl-2-thiophen-2-ylethanol
CID 105087131
1-(3,6-Dimethylpyridazin-4-yl)-2-thiophen-2-ylethanol
CID 105087142
1-(3-Ethyl-6-methylpyridazin-4-yl)-2-thiophen-2-ylethanol
CID 105087154
2-(5-Bromothiophen-2-yl)-1-pyridazin-4-ylethanol
CID 105087224
2-(5-Chlorothiophen-2-yl)-1-pyridazin-4-ylethanol
CID 105087376
2-(5-Ethylthiophen-2-yl)-1-pyridazin-4-ylethanol
CID 105087604

Frequently Asked Questions

What is the IUPAC name of pyridazin-4-yl(thiophen-2-yl)methanol?
The IUPAC name of pyridazin-4-yl(thiophen-2-yl)methanol (CID 105079898) is pyridazin-4-yl(thiophen-2-yl)methanol.
What is the SMILES notation for pyridazin-4-yl(thiophen-2-yl)methanol?
The canonical SMILES for pyridazin-4-yl(thiophen-2-yl)methanol is OC(c1ccnnc1)c1cccs1.
What is the InChIKey of pyridazin-4-yl(thiophen-2-yl)methanol?
The InChIKey is TWBMOIJQZDPZAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS/c12-9(8-2-1-5-13-8)7-3-4-10-11-6-7/h1-6,9,12H.
What are the key properties of pyridazin-4-yl(thiophen-2-yl)methanol?
pyridazin-4-yl(thiophen-2-yl)methanol has a molecular weight of 192.24 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for pyridazin-4-yl(thiophen-2-yl)methanol is sourced from PubChem (CID 105079898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).