3-methoxy-6-thiophen-3-ylpyridazine

C9H8N2OS — CID 16744458

IUPAC3-methoxy-6-thiophen-3-ylpyridazine
SMILESCOc1ccc(-c2ccsc2)nn1
InChIInChI=1S/C9H8N2OS/c1-12-9-3-2-8(10-11-9)7-4-5-13-6-7/h2-6H,1H3
InChIKeyNPFLZQYZINRWSH-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.21
Rot. Bonds2

About 3-methoxy-6-thiophen-3-ylpyridazine

3-methoxy-6-thiophen-3-ylpyridazine (PubChem CID 16744458) has the molecular formula C9H8N2OS and a molecular weight of 192.24 g/mol. Its IUPAC name is 3-methoxy-6-thiophen-3-ylpyridazine.

Molecular Properties

Compound Name3-methoxy-6-thiophen-3-ylpyridazine
PubChem CID16744458
Molecular FormulaC9H8N2OS
Molecular Weight192.24 g/mol
Exact Mass192.04
IUPAC Name3-methoxy-6-thiophen-3-ylpyridazine
SMILESCOc1ccc(-c2ccsc2)nn1
InChIInChI=1S/C9H8N2OS/c1-12-9-3-2-8(10-11-9)7-4-5-13-6-7/h2-6H,1H3
InChIKeyNPFLZQYZINRWSH-UHFFFAOYSA-N
XLogP2.21
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-6-thiophen-3-ylpyridazine?
The IUPAC name of 3-methoxy-6-thiophen-3-ylpyridazine (CID 16744458) is 3-methoxy-6-thiophen-3-ylpyridazine.
What is the SMILES notation for 3-methoxy-6-thiophen-3-ylpyridazine?
The canonical SMILES for 3-methoxy-6-thiophen-3-ylpyridazine is COc1ccc(-c2ccsc2)nn1.
What is the InChIKey of 3-methoxy-6-thiophen-3-ylpyridazine?
The InChIKey is NPFLZQYZINRWSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS/c1-12-9-3-2-8(10-11-9)7-4-5-13-6-7/h2-6H,1H3.
What are the key properties of 3-methoxy-6-thiophen-3-ylpyridazine?
3-methoxy-6-thiophen-3-ylpyridazine has a molecular weight of 192.24 g/mol, XLogP of 2.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-6-thiophen-3-ylpyridazine is sourced from PubChem (CID 16744458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).