2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole

C9H8N2OS — CID 155798528

IUPAC2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole
SMILESCc1ncccc1Oc1nccs1
InChIInChI=1S/C9H8N2OS/c1-7-8(3-2-4-10-7)12-9-11-5-6-13-9/h2-6H,1H3
InChIKeyFUTIDAUBKKJOOI-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.64
Rot. Bonds2

About 2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole

2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole (PubChem CID 155798528) has the molecular formula C9H8N2OS and a molecular weight of 192.24 g/mol. Its IUPAC name is 2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole.

Molecular Properties

Compound Name2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole
PubChem CID155798528
Molecular FormulaC9H8N2OS
Molecular Weight192.24 g/mol
Exact Mass192.04
IUPAC Name2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole
SMILESCc1ncccc1Oc1nccs1
InChIInChI=1S/C9H8N2OS/c1-7-8(3-2-4-10-7)12-9-11-5-6-13-9/h2-6H,1H3
InChIKeyFUTIDAUBKKJOOI-UHFFFAOYSA-N
XLogP2.64
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 ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole?
The IUPAC name of 2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole (CID 155798528) is 2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole.
What is the SMILES notation for 2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole?
The canonical SMILES for 2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole is Cc1ncccc1Oc1nccs1.
What is the InChIKey of 2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole?
The InChIKey is FUTIDAUBKKJOOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS/c1-7-8(3-2-4-10-7)12-9-11-5-6-13-9/h2-6H,1H3.
What are the key properties of 2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole?
2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole has a molecular weight of 192.24 g/mol, XLogP of 2.64, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole is sourced from PubChem (CID 155798528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).