N-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide

C9H11FN2OS — CID 126790744

IUPACN-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide
SMILESO=C(NC1CCC(F)C1)c1ccsn1
InChIInChI=1S/C9H11FN2OS/c10-6-1-2-7(5-6)11-9(13)8-3-4-14-12-8/h3-4,6-7H,1-2,5H2,(H,11,13)
InChIKeyOXOWPSBCBXVKCG-UHFFFAOYSA-N
MW214.26 g/mol
LogP1.76
Rot. Bonds2

About N-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide

N-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide (PubChem CID 126790744) has the molecular formula C9H11FN2OS and a molecular weight of 214.26 g/mol. Its IUPAC name is N-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide
PubChem CID126790744
Molecular FormulaC9H11FN2OS
Molecular Weight214.26 g/mol
Exact Mass214.06
IUPAC NameN-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide
SMILESO=C(NC1CCC(F)C1)c1ccsn1
InChIInChI=1S/C9H11FN2OS/c10-6-1-2-7(5-6)11-9(13)8-3-4-14-12-8/h3-4,6-7H,1-2,5H2,(H,11,13)
InChIKeyOXOWPSBCBXVKCG-UHFFFAOYSA-N
XLogP1.76
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide 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 N-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide?
The IUPAC name of N-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide (CID 126790744) is N-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide.
What is the SMILES notation for N-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide?
The canonical SMILES for N-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide is O=C(NC1CCC(F)C1)c1ccsn1.
What is the InChIKey of N-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide?
The InChIKey is OXOWPSBCBXVKCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN2OS/c10-6-1-2-7(5-6)11-9(13)8-3-4-14-12-8/h3-4,6-7H,1-2,5H2,(H,11,13).
What are the key properties of N-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide?
N-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide has a molecular weight of 214.26 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorocyclopentyl)-1,2-thiazole-3-carboxamide is sourced from PubChem (CID 126790744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).