[6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol

C9H8N2OS — CID 153422635

IUPAC[6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol
SMILESOCc1ccc(-c2cncs2)nc1
InChIInChI=1S/C9H8N2OS/c12-5-7-1-2-8(11-3-7)9-4-10-6-13-9/h1-4,6,12H,5H2
InChIKeyABBFXYQSHFWOBN-UHFFFAOYSA-N
MW192.24 g/mol
LogP1.70
Rot. Bonds2

About [6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol

[6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol (PubChem CID 153422635) has the molecular formula C9H8N2OS and a molecular weight of 192.24 g/mol. Its IUPAC name is [6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol
PubChem CID153422635
Molecular FormulaC9H8N2OS
Molecular Weight192.24 g/mol
Exact Mass192.04
IUPAC Name[6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol
SMILESOCc1ccc(-c2cncs2)nc1
InChIInChI=1S/C9H8N2OS/c12-5-7-1-2-8(11-3-7)9-4-10-6-13-9/h1-4,6,12H,5H2
InChIKeyABBFXYQSHFWOBN-UHFFFAOYSA-N
XLogP1.70
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 ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol?
The IUPAC name of [6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol (CID 153422635) is [6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol.
What is the SMILES notation for [6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol?
The canonical SMILES for [6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol is OCc1ccc(-c2cncs2)nc1.
What is the InChIKey of [6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol?
The InChIKey is ABBFXYQSHFWOBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS/c12-5-7-1-2-8(11-3-7)9-4-10-6-13-9/h1-4,6,12H,5H2.
What are the key properties of [6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol?
[6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol has a molecular weight of 192.24 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(1,3-thiazol-5-yl)-3-pyridinyl]methanol is sourced from PubChem (CID 153422635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).