8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol

Name: 8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₉H₁₄N₄OS — CID 66278590

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol

SMILESNc1nsc(N2C3CCC2CC(O)C3)n1

InChIInChI=1S/C9H14N4OS/c10-8-11-9(15-12-8)13-5-1-2-6(13)4-7(14)3-5/h5-7,14H,1-4H2,(H2,10,12)

InChIKeyCMFCVANUQYIADI-UHFFFAOYSA-N

MW226.30 g/mol

LogP0.61

Rot. Bonds1

About 8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol

8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol (PubChem CID 66278590) has the molecular formula C₉H₁₄N₄OS and a molecular weight of 226.30 g/mol. Its IUPAC name is 8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol.

Molecular Properties

Compound Name	8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol
PubChem CID	66278590
Molecular Formula	C₉H₁₄N₄OS
Molecular Weight	226.30 g/mol
Exact Mass	226.09
IUPAC Name	8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol
SMILES	Nc1nsc(N2C3CCC2CC(O)C3)n1
InChI	InChI=1S/C9H14N4OS/c10-8-11-9(15-12-8)13-5-1-2-6(13)4-7(14)3-5/h5-7,14H,1-4H2,(H2,10,12)
InChIKey	CMFCVANUQYIADI-UHFFFAOYSA-N
XLogP	0.61
TPSA	75.27 Å²
H-Bond Donors	2
H-Bond Acceptors	6
Rotatable Bonds	1
Heavy Atoms	15
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	226.30
LogP ≤ 5	0.61
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol?

The IUPAC name of 8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol (CID 66278590) is 8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol.

What is the SMILES notation for 8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol?

The canonical SMILES for 8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol is Nc1nsc(N2C3CCC2CC(O)C3)n1.

What is the InChIKey of 8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol?

The InChIKey is CMFCVANUQYIADI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4OS/c10-8-11-9(15-12-8)13-5-1-2-6(13)4-7(14)3-5/h5-7,14H,1-4H2,(H2,10,12).

What are the key properties of 8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol?

8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol has a molecular weight of 226.30 g/mol, XLogP of 0.61, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 8-(3-amino-1,2,4-thiadiazol-5-yl)-8-azabicyclo[3.2.1]octan-3-ol is sourced from PubChem (CID 66278590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

PubChem CID 66278590 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.

For research and educational use only — not medical advice. This page is compiled automatically from public databases. It is not written or reviewed by a clinician. Do not start, stop or change any treatment based on it; consult a qualified healthcare professional. Spotted an error? See our corrections policy or email hello@molforge.ai.