1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine

C8H13FN2S — CID 84770829

IUPAC1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine
SMILESCC(N)c1csc(C(C)(C)F)n1
InChIInChI=1S/C8H13FN2S/c1-5(10)6-4-12-7(11-6)8(2,3)9/h4-5H,10H2,1-3H3
InChIKeyMSYMJWHPPWWKBX-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.37
Rot. Bonds2

About 1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine

1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine (PubChem CID 84770829) has the molecular formula C8H13FN2S and a molecular weight of 188.27 g/mol. Its IUPAC name is 1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine.

Molecular Properties

Compound Name1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine
PubChem CID84770829
Molecular FormulaC8H13FN2S
Molecular Weight188.27 g/mol
Exact Mass188.08
IUPAC Name1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine
SMILESCC(N)c1csc(C(C)(C)F)n1
InChIInChI=1S/C8H13FN2S/c1-5(10)6-4-12-7(11-6)8(2,3)9/h4-5H,10H2,1-3H3
InChIKeyMSYMJWHPPWWKBX-UHFFFAOYSA-N
XLogP2.37
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine 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

1-[2-(1,1-difluoroethyl)-1,3-thiazol-4-yl]ethanamine
CID 84772376
1-[2-(3-methoxypentan-3-yl)-1,3-thiazol-4-yl]ethanamine
CID 116774571
2-(4-propan-2-yl-1,3-thiazol-2-yl)propan-2-amine
CID 61337262
1-[2-(2,2-dimethylpropyl)-1,3-thiazol-4-yl]ethanamine
CID 64543263
4-(1-aminoethyl)-1,3-thiazol-2-amine
CID 64545491
2-tert-butyl-4-propan-2-yl-1,3-thiazole
CID 22975254
(1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine
CID 51898160
1-(2-phenyl-1,3-thiazol-4-yl)ethanamine
CID 12009827
1-[2-(2-methylpropyl)-1,3-thiazol-4-yl]ethanamine
CID 64544064
2-[4-(1-amino-2-methylpropyl)-1,3-thiazol-2-yl]-2-methylpropanenitrile
CID 103097424
1-[2-[4-(trifluoromethylsulfanyl)phenyl]-1,3-thiazol-4-yl]ethanamine
CID 64543107
1-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]ethanamine
CID 64544065

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine?
The IUPAC name of 1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine (CID 84770829) is 1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine.
What is the SMILES notation for 1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine?
The canonical SMILES for 1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine is CC(N)c1csc(C(C)(C)F)n1.
What is the InChIKey of 1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine?
The InChIKey is MSYMJWHPPWWKBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13FN2S/c1-5(10)6-4-12-7(11-6)8(2,3)9/h4-5H,10H2,1-3H3.
What are the key properties of 1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine?
1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine has a molecular weight of 188.27 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine is sourced from PubChem (CID 84770829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).