3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine

C8H11FN2S — CID 131218899

IUPAC3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine
SMILESCc1cc(C2(F)CC(N)C2)sn1
InChIInChI=1S/C8H11FN2S/c1-5-2-7(12-11-5)8(9)3-6(10)4-8/h2,6H,3-4,10H2,1H3
InChIKeyTZYKLGNOUUMGRC-UHFFFAOYSA-N
MW186.25 g/mol
LogP1.74
Rot. Bonds1

About 3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine

3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine (PubChem CID 131218899) has the molecular formula C8H11FN2S and a molecular weight of 186.25 g/mol. Its IUPAC name is 3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine
PubChem CID131218899
Molecular FormulaC8H11FN2S
Molecular Weight186.25 g/mol
Exact Mass186.06
IUPAC Name3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine
SMILESCc1cc(C2(F)CC(N)C2)sn1
InChIInChI=1S/C8H11FN2S/c1-5-2-7(12-11-5)8(9)3-6(10)4-8/h2,6H,3-4,10H2,1H3
InChIKeyTZYKLGNOUUMGRC-UHFFFAOYSA-N
XLogP1.74
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine 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 3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine?
The IUPAC name of 3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine (CID 131218899) is 3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine.
What is the SMILES notation for 3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine?
The canonical SMILES for 3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine is Cc1cc(C2(F)CC(N)C2)sn1.
What is the InChIKey of 3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine?
The InChIKey is TZYKLGNOUUMGRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2S/c1-5-2-7(12-11-5)8(9)3-6(10)4-8/h2,6H,3-4,10H2,1H3.
What are the key properties of 3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine?
3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine has a molecular weight of 186.25 g/mol, XLogP of 1.74, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-3-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-amine is sourced from PubChem (CID 131218899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).