(2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol

C8H7N3OS — CID 23111740

IUPAC(2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol
SMILESOCc1csc(-c2cnccn2)n1
InChIInChI=1S/C8H7N3OS/c12-4-6-5-13-8(11-6)7-3-9-1-2-10-7/h1-3,5,12H,4H2
InChIKeyFEZRHXOTTFDURA-UHFFFAOYSA-N
MW193.23 g/mol
LogP1.09
Rot. Bonds2

About (2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol

(2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol (PubChem CID 23111740) has the molecular formula C8H7N3OS and a molecular weight of 193.23 g/mol. Its IUPAC name is (2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol.

Molecular Properties

Compound Name(2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol
PubChem CID23111740
Molecular FormulaC8H7N3OS
Molecular Weight193.23 g/mol
Exact Mass193.03
IUPAC Name(2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol
SMILESOCc1csc(-c2cnccn2)n1
InChIInChI=1S/C8H7N3OS/c12-4-6-5-13-8(11-6)7-3-9-1-2-10-7/h1-3,5,12H,4H2
InChIKeyFEZRHXOTTFDURA-UHFFFAOYSA-N
XLogP1.09
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.23
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol?
The IUPAC name of (2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol (CID 23111740) is (2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol.
What is the SMILES notation for (2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol?
The canonical SMILES for (2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol is OCc1csc(-c2cnccn2)n1.
What is the InChIKey of (2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol?
The InChIKey is FEZRHXOTTFDURA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3OS/c12-4-6-5-13-8(11-6)7-3-9-1-2-10-7/h1-3,5,12H,4H2.
What are the key properties of (2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol?
(2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol has a molecular weight of 193.23 g/mol, XLogP of 1.09, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-pyrazin-2-yl-1,3-thiazol-4-yl)methanol is sourced from PubChem (CID 23111740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).