5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole

C8H11FN2OS — CID 139028505

IUPAC5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole
SMILESCc1nsc(O[C@@H]2CCC[C@H]2F)n1
InChIInChI=1S/C8H11FN2OS/c1-5-10-8(13-11-5)12-7-4-2-3-6(7)9/h6-7H,2-4H2,1H3/t6-,7-/m1/s1
InChIKeyBYNWIAITONEEHZ-RNFRBKRXSA-N
MW202.25 g/mol
LogP2.12
Rot. Bonds2

About 5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole

5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole (PubChem CID 139028505) has the molecular formula C8H11FN2OS and a molecular weight of 202.25 g/mol. Its IUPAC name is 5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole.

Molecular Properties

Compound Name5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole
PubChem CID139028505
Molecular FormulaC8H11FN2OS
Molecular Weight202.25 g/mol
Exact Mass202.06
IUPAC Name5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole
SMILESCc1nsc(O[C@@H]2CCC[C@H]2F)n1
InChIInChI=1S/C8H11FN2OS/c1-5-10-8(13-11-5)12-7-4-2-3-6(7)9/h6-7H,2-4H2,1H3/t6-,7-/m1/s1
InChIKeyBYNWIAITONEEHZ-RNFRBKRXSA-N
XLogP2.12
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole?
The IUPAC name of 5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole (CID 139028505) is 5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole.
What is the SMILES notation for 5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole?
The canonical SMILES for 5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole is Cc1nsc(O[C@@H]2CCC[C@H]2F)n1.
What is the InChIKey of 5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole?
The InChIKey is BYNWIAITONEEHZ-RNFRBKRXSA-N. The full InChI is InChI=1S/C8H11FN2OS/c1-5-10-8(13-11-5)12-7-4-2-3-6(7)9/h6-7H,2-4H2,1H3/t6-,7-/m1/s1.
What are the key properties of 5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole?
5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole has a molecular weight of 202.25 g/mol, XLogP of 2.12, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1R,2R)-2-fluorocyclopentyl]oxy-3-methyl-1,2,4-thiadiazole is sourced from PubChem (CID 139028505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).