[3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine

C9H7F3N2S2 — CID 106783886

IUPAC[3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine
SMILESNCc1sccc1-c1cnc(C(F)(F)F)s1
InChIInChI=1S/C9H7F3N2S2/c10-9(11,12)8-14-4-7(16-8)5-1-2-15-6(5)3-13/h1-2,4H,3,13H2
InChIKeyYJXDASUIHZAISQ-UHFFFAOYSA-N
MW264.30 g/mol
LogP3.35
Rot. Bonds2

About [3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine

[3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine (PubChem CID 106783886) has the molecular formula C9H7F3N2S2 and a molecular weight of 264.30 g/mol. Its IUPAC name is [3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine.

Molecular Properties

Compound Name[3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine
PubChem CID106783886
Molecular FormulaC9H7F3N2S2
Molecular Weight264.30 g/mol
Exact Mass264.00
IUPAC Name[3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine
SMILESNCc1sccc1-c1cnc(C(F)(F)F)s1
InChIInChI=1S/C9H7F3N2S2/c10-9(11,12)8-14-4-7(16-8)5-1-2-15-6(5)3-13/h1-2,4H,3,13H2
InChIKeyYJXDASUIHZAISQ-UHFFFAOYSA-N
XLogP3.35
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.30
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine 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

[2-[2-(trifluoromethyl)-1,3-thiazol-5-yl]phenyl]methanamine
CID 106783883
3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyridin-2-amine
CID 106783896
8-[2-(trifluoromethyl)-1,3-thiazol-5-yl]quinazolin-4-amine
CID 175958236
5-[2-(trifluoromethyl)-1,3-thiazol-5-yl]-1H-pyrimidin-6-one
CID 106787601
1-[4-chloro-2-[2-(trifluoromethyl)-1,3-thiazol-5-yl]phenyl]-N-methylmethanamine
CID 106784013
2-methoxy-6-[2-(trifluoromethyl)-1,3-thiazol-5-yl]phenol
CID 106784585
N-[[3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]furan-2-yl]methyl]propan-1-amine
CID 106888389
1-(3H-benzimidazol-5-yl)-1-[4-[2-(trifluoromethyl)-1,3-thiazol-5-yl]phenyl]ethane-1,2-diamine
CID 146422677
[3-(1,4-dimethylpyrazol-5-yl)thiophen-2-yl]methanamine
CID 130527498
5-(6-bromo-2-pyridinyl)-2-(trifluoromethyl)-1,3-thiazole
CID 106784270
N-[[4-chloro-2-[2-(trifluoromethyl)-1,3-thiazol-5-yl]phenyl]methyl]cyclopropanamine
CID 106783947
N-[[3-fluoro-4-[2-(trifluoromethyl)-1,3-thiazol-5-yl]phenyl]methyl]propan-1-amine
CID 106783983

Frequently Asked Questions

What is the IUPAC name of [3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine?
The IUPAC name of [3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine (CID 106783886) is [3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine.
What is the SMILES notation for [3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine?
The canonical SMILES for [3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine is NCc1sccc1-c1cnc(C(F)(F)F)s1.
What is the InChIKey of [3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine?
The InChIKey is YJXDASUIHZAISQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F3N2S2/c10-9(11,12)8-14-4-7(16-8)5-1-2-15-6(5)3-13/h1-2,4H,3,13H2.
What are the key properties of [3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine?
[3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine has a molecular weight of 264.30 g/mol, XLogP of 3.35, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]thiophen-2-yl]methanamine is sourced from PubChem (CID 106783886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).