5-methoxy-2-pyridin-2-yl-1,3-thiazole

C9H8N2OS — CID 91540241

IUPAC5-methoxy-2-pyridin-2-yl-1,3-thiazole
SMILESCOc1cnc(-c2ccccn2)s1
InChIInChI=1S/C9H8N2OS/c1-12-8-6-11-9(13-8)7-4-2-3-5-10-7/h2-6H,1H3
InChIKeyLSWGIOQASWBBNV-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.21
Rot. Bonds2

About 5-methoxy-2-pyridin-2-yl-1,3-thiazole

5-methoxy-2-pyridin-2-yl-1,3-thiazole (PubChem CID 91540241) has the molecular formula C9H8N2OS and a molecular weight of 192.24 g/mol. Its IUPAC name is 5-methoxy-2-pyridin-2-yl-1,3-thiazole.

Molecular Properties

Compound Name5-methoxy-2-pyridin-2-yl-1,3-thiazole
PubChem CID91540241
Molecular FormulaC9H8N2OS
Molecular Weight192.24 g/mol
Exact Mass192.04
IUPAC Name5-methoxy-2-pyridin-2-yl-1,3-thiazole
SMILESCOc1cnc(-c2ccccn2)s1
InChIInChI=1S/C9H8N2OS/c1-12-8-6-11-9(13-8)7-4-2-3-5-10-7/h2-6H,1H3
InChIKeyLSWGIOQASWBBNV-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 5-methoxy-2-pyridin-2-yl-1,3-thiazole?
The IUPAC name of 5-methoxy-2-pyridin-2-yl-1,3-thiazole (CID 91540241) is 5-methoxy-2-pyridin-2-yl-1,3-thiazole.
What is the SMILES notation for 5-methoxy-2-pyridin-2-yl-1,3-thiazole?
The canonical SMILES for 5-methoxy-2-pyridin-2-yl-1,3-thiazole is COc1cnc(-c2ccccn2)s1.
What is the InChIKey of 5-methoxy-2-pyridin-2-yl-1,3-thiazole?
The InChIKey is LSWGIOQASWBBNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS/c1-12-8-6-11-9(13-8)7-4-2-3-5-10-7/h2-6H,1H3.
What are the key properties of 5-methoxy-2-pyridin-2-yl-1,3-thiazole?
5-methoxy-2-pyridin-2-yl-1,3-thiazole 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 5-methoxy-2-pyridin-2-yl-1,3-thiazole is sourced from PubChem (CID 91540241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).