4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine

C11H10ClFN2S — CID 62082901

IUPAC4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine
SMILESCCc1nc(-c2c(F)cccc2Cl)c(N)s1
InChIInChI=1S/C11H10ClFN2S/c1-2-8-15-10(11(14)16-8)9-6(12)4-3-5-7(9)13/h3-5H,2,14H2,1H3
InChIKeyOOTRNLYJTJIVAA-UHFFFAOYSA-N
MW256.73 g/mol
LogP3.75
Rot. Bonds2

About 4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine

4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine (PubChem CID 62082901) has the molecular formula C11H10ClFN2S and a molecular weight of 256.73 g/mol. Its IUPAC name is 4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine.

Molecular Properties

Compound Name4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine
PubChem CID62082901
Molecular FormulaC11H10ClFN2S
Molecular Weight256.73 g/mol
Exact Mass256.02
IUPAC Name4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine
SMILESCCc1nc(-c2c(F)cccc2Cl)c(N)s1
InChIInChI=1S/C11H10ClFN2S/c1-2-8-15-10(11(14)16-8)9-6(12)4-3-5-7(9)13/h3-5H,2,14H2,1H3
InChIKeyOOTRNLYJTJIVAA-UHFFFAOYSA-N
XLogP3.75
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.73
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(2-chloro-6-fluorophenyl)-1,2,4-triazine-3,5-diamine
CID 23311127
[2-(2-chloro-6-fluorophenyl)-4-ethyl-1,3-thiazol-5-yl]methanamine
CID 104840974
3-(2-chloro-6-fluorophenyl)pyrazin-2-amine
CID 112559171
2-cyclopropyl-4-(2,6-difluorophenyl)-1,3-thiazol-5-amine
CID 62077011
2-ethyl-4-(2-ethylphenyl)-1,3-thiazol-5-amine
CID 62392275
6-chloro-2-(2-chloro-6-fluorophenyl)imidazo[1,2-a]pyridin-3-amine
CID 63617429
ethyl 2-amino-5-(2-chloro-6-fluorophenyl)-1,3-thiazole-4-carboxylate
CID 53271473
2-(2-chloro-6-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine
CID 114933530
2-(2-chloro-6-fluorophenyl)-5-methoxyimidazo[1,2-a]pyridin-3-amine
CID 58402620
4-(4-fluoro-3-methylphenyl)-2-propyl-1,3-thiazol-5-amine
CID 62122450
2-(2-chloro-6-fluorophenyl)-1,3-benzothiazol-7-amine
CID 95482954
ethyl 2-(2-chloro-6-fluorophenyl)-5-methyl-1,3-thiazole-4-carboxylate
CID 116526266

Frequently Asked Questions

What is the IUPAC name of 4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine?
The IUPAC name of 4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine (CID 62082901) is 4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine.
What is the SMILES notation for 4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine?
The canonical SMILES for 4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine is CCc1nc(-c2c(F)cccc2Cl)c(N)s1.
What is the InChIKey of 4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine?
The InChIKey is OOTRNLYJTJIVAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClFN2S/c1-2-8-15-10(11(14)16-8)9-6(12)4-3-5-7(9)13/h3-5H,2,14H2,1H3.
What are the key properties of 4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine?
4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine has a molecular weight of 256.73 g/mol, XLogP of 3.75, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chloro-6-fluorophenyl)-2-ethyl-1,3-thiazol-5-amine is sourced from PubChem (CID 62082901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).