5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine

C9H8FN3S — CID 115925028

IUPAC5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine
SMILESFc1ccc(NCc2cncs2)nc1
InChIInChI=1S/C9H8FN3S/c10-7-1-2-9(12-3-7)13-5-8-4-11-6-14-8/h1-4,6H,5H2,(H,12,13)
InChIKeyUNNGTYQGIXRYLB-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.29
Rot. Bonds3

About 5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine

5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine (PubChem CID 115925028) has the molecular formula C9H8FN3S and a molecular weight of 209.25 g/mol. Its IUPAC name is 5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine
PubChem CID115925028
Molecular FormulaC9H8FN3S
Molecular Weight209.25 g/mol
Exact Mass209.04
IUPAC Name5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine
SMILESFc1ccc(NCc2cncs2)nc1
InChIInChI=1S/C9H8FN3S/c10-7-1-2-9(12-3-7)13-5-8-4-11-6-14-8/h1-4,6H,5H2,(H,12,13)
InChIKeyUNNGTYQGIXRYLB-UHFFFAOYSA-N
XLogP2.29
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine?
The IUPAC name of 5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine (CID 115925028) is 5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine.
What is the SMILES notation for 5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine?
The canonical SMILES for 5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine is Fc1ccc(NCc2cncs2)nc1.
What is the InChIKey of 5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine?
The InChIKey is UNNGTYQGIXRYLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN3S/c10-7-1-2-9(12-3-7)13-5-8-4-11-6-14-8/h1-4,6H,5H2,(H,12,13).
What are the key properties of 5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine?
5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine has a molecular weight of 209.25 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(1,3-thiazol-5-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 115925028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).