3-(1,3-thiazol-5-yl)pyridin-4-amine

C8H7N3S — CID 130114568

IUPAC3-(1,3-thiazol-5-yl)pyridin-4-amine
SMILESNc1ccncc1-c1cncs1
InChIInChI=1S/C8H7N3S/c9-7-1-2-10-3-6(7)8-4-11-5-12-8/h1-5H,(H2,9,10)
InChIKeyZBVBOAVVGGSTDV-UHFFFAOYSA-N
MW177.23 g/mol
LogP1.79
Rot. Bonds1

About 3-(1,3-thiazol-5-yl)pyridin-4-amine

3-(1,3-thiazol-5-yl)pyridin-4-amine (PubChem CID 130114568) has the molecular formula C8H7N3S and a molecular weight of 177.23 g/mol. Its IUPAC name is 3-(1,3-thiazol-5-yl)pyridin-4-amine.

Molecular Properties

Compound Name3-(1,3-thiazol-5-yl)pyridin-4-amine
PubChem CID130114568
Molecular FormulaC8H7N3S
Molecular Weight177.23 g/mol
Exact Mass177.04
IUPAC Name3-(1,3-thiazol-5-yl)pyridin-4-amine
SMILESNc1ccncc1-c1cncs1
InChIInChI=1S/C8H7N3S/c9-7-1-2-10-3-6(7)8-4-11-5-12-8/h1-5H,(H2,9,10)
InChIKeyZBVBOAVVGGSTDV-UHFFFAOYSA-N
XLogP1.79
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.23
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(1,3-thiazol-5-yl)pyridin-4-amine?
The IUPAC name of 3-(1,3-thiazol-5-yl)pyridin-4-amine (CID 130114568) is 3-(1,3-thiazol-5-yl)pyridin-4-amine.
What is the SMILES notation for 3-(1,3-thiazol-5-yl)pyridin-4-amine?
The canonical SMILES for 3-(1,3-thiazol-5-yl)pyridin-4-amine is Nc1ccncc1-c1cncs1.
What is the InChIKey of 3-(1,3-thiazol-5-yl)pyridin-4-amine?
The InChIKey is ZBVBOAVVGGSTDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3S/c9-7-1-2-10-3-6(7)8-4-11-5-12-8/h1-5H,(H2,9,10).
What are the key properties of 3-(1,3-thiazol-5-yl)pyridin-4-amine?
3-(1,3-thiazol-5-yl)pyridin-4-amine has a molecular weight of 177.23 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,3-thiazol-5-yl)pyridin-4-amine is sourced from PubChem (CID 130114568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).