5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine

C8H7N3OS2 — CID 15729197

IUPAC5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine
SMILESNc1ncc(S(=O)c2cccnc2)s1
InChIInChI=1S/C8H7N3OS2/c9-8-11-5-7(13-8)14(12)6-2-1-3-10-4-6/h1-5H,(H2,9,11)
InChIKeyGLMVXPXJSIRYDN-UHFFFAOYSA-N
MW225.30 g/mol
LogP1.29
Rot. Bonds2

About 5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine

5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine (PubChem CID 15729197) has the molecular formula C8H7N3OS2 and a molecular weight of 225.30 g/mol. Its IUPAC name is 5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine
PubChem CID15729197
Molecular FormulaC8H7N3OS2
Molecular Weight225.30 g/mol
Exact Mass225.00
IUPAC Name5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine
SMILESNc1ncc(S(=O)c2cccnc2)s1
InChIInChI=1S/C8H7N3OS2/c9-8-11-5-7(13-8)14(12)6-2-1-3-10-4-6/h1-5H,(H2,9,11)
InChIKeyGLMVXPXJSIRYDN-UHFFFAOYSA-N
XLogP1.29
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine?
The IUPAC name of 5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine (CID 15729197) is 5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine is Nc1ncc(S(=O)c2cccnc2)s1.
What is the InChIKey of 5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine?
The InChIKey is GLMVXPXJSIRYDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3OS2/c9-8-11-5-7(13-8)14(12)6-2-1-3-10-4-6/h1-5H,(H2,9,11).
What are the key properties of 5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine?
5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine has a molecular weight of 225.30 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-3-ylsulfinyl-1,3-thiazol-2-amine is sourced from PubChem (CID 15729197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).