5-fluoro-4-propan-2-yl-1,3-thiazole

C6H8FNS — CID 138494786

IUPAC5-fluoro-4-propan-2-yl-1,3-thiazole
SMILESCC(C)c1ncsc1F
InChIInChI=1S/C6H8FNS/c1-4(2)5-6(7)9-3-8-5/h3-4H,1-2H3
InChIKeyBYPATIOCHYGVPB-UHFFFAOYSA-N
MW145.20 g/mol
LogP2.41
Rot. Bonds1

About 5-fluoro-4-propan-2-yl-1,3-thiazole

5-fluoro-4-propan-2-yl-1,3-thiazole (PubChem CID 138494786) has the molecular formula C6H8FNS and a molecular weight of 145.20 g/mol. Its IUPAC name is 5-fluoro-4-propan-2-yl-1,3-thiazole.

Molecular Properties

Compound Name5-fluoro-4-propan-2-yl-1,3-thiazole
PubChem CID138494786
Molecular FormulaC6H8FNS
Molecular Weight145.20 g/mol
Exact Mass145.04
IUPAC Name5-fluoro-4-propan-2-yl-1,3-thiazole
SMILESCC(C)c1ncsc1F
InChIInChI=1S/C6H8FNS/c1-4(2)5-6(7)9-3-8-5/h3-4H,1-2H3
InChIKeyBYPATIOCHYGVPB-UHFFFAOYSA-N
XLogP2.41
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-fluoro-4-propan-2-yl-1,3-thiazole with MolForge

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

Launch Full Analysis

Related Compounds

5-methyl-4-propan-2-yl-1,3-thiazole
CID 45121704
5-(bromomethyl)-4-propan-2-yl-1,3-thiazole
CID 59589368
4-propan-2-yl-1,3-thiazole-5-carboxylic acid
CID 13015604
2-(4-propan-2-yl-1,3-thiazol-5-yl)propan-2-ol
CID 82433495
6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine
CID 118410775
5-[1-(2-fluorophenyl)ethylsulfanyl]-4-propan-2-yl-1,3-thiazole
CID 141313942
4-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine
CID 76850460
5-(4-propan-2-yl-1,3-thiazol-5-yl)-1,3,4-thiadiazol-2-amine
CID 82433506
7-methyl-6-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine
CID 139376342
N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide
CID 23548812
ethane;7-fluoro-4-propan-2-yl-1,3-benzothiazole
CID 163391719
1-methylsulfonyl-N-(4-propan-2-yl-1,3-thiazol-5-yl)cyclopropane-1-carboxamide
CID 138017224

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-propan-2-yl-1,3-thiazole?
The IUPAC name of 5-fluoro-4-propan-2-yl-1,3-thiazole (CID 138494786) is 5-fluoro-4-propan-2-yl-1,3-thiazole.
What is the SMILES notation for 5-fluoro-4-propan-2-yl-1,3-thiazole?
The canonical SMILES for 5-fluoro-4-propan-2-yl-1,3-thiazole is CC(C)c1ncsc1F.
What is the InChIKey of 5-fluoro-4-propan-2-yl-1,3-thiazole?
The InChIKey is BYPATIOCHYGVPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8FNS/c1-4(2)5-6(7)9-3-8-5/h3-4H,1-2H3.
What are the key properties of 5-fluoro-4-propan-2-yl-1,3-thiazole?
5-fluoro-4-propan-2-yl-1,3-thiazole has a molecular weight of 145.20 g/mol, XLogP of 2.41, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-propan-2-yl-1,3-thiazole is sourced from PubChem (CID 138494786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).