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

C11H10ClFN2S — CID 83157073

IUPAC4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine
SMILESCCN(c1cccc(F)c1)c1nc(Cl)cs1
InChIInChI=1S/C11H10ClFN2S/c1-2-15(11-14-10(12)7-16-11)9-5-3-4-8(13)6-9/h3-7H,2H2,1H3
InChIKeyFUGWIQMYPCQHCP-UHFFFAOYSA-N
MW256.73 g/mol
LogP4.09
Rot. Bonds3

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

4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine (PubChem CID 83157073) has the molecular formula C11H10ClFN2S and a molecular weight of 256.73 g/mol. Its IUPAC name is 4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine
PubChem CID83157073
Molecular FormulaC11H10ClFN2S
Molecular Weight256.73 g/mol
Exact Mass256.02
IUPAC Name4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine
SMILESCCN(c1cccc(F)c1)c1nc(Cl)cs1
InChIInChI=1S/C11H10ClFN2S/c1-2-15(11-14-10(12)7-16-11)9-5-3-4-8(13)6-9/h3-7H,2H2,1H3
InChIKeyFUGWIQMYPCQHCP-UHFFFAOYSA-N
XLogP4.09
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.73
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-4-[1-(ethylamino)ethyl]-N-(3-fluorophenyl)-1,3-thiazol-2-amine
CID 64542740
4-chloro-N-ethyl-N-(2-fluorophenyl)-1,3-thiazol-2-amine
CID 83157193
6-chloro-N-ethyl-N-(3-fluorophenyl)-2-methylpyrimidin-4-amine
CID 62480942
4-chloro-2-(N-ethyl-3-fluoroanilino)-1,3-thiazole-5-carbaldehyde
CID 80687160
6-chloro-2-N-ethyl-2-N-(3-fluorophenyl)pyridine-2,3-diamine
CID 115474017
3,5,6-trichloro-N-ethyl-N-(3-fluorophenyl)pyridin-2-amine
CID 102750868
2-(N-ethyl-3-fluoroanilino)-4-methyl-1,3-thiazole-5-carboxylic acid
CID 62765126
4-(N-ethyl-3-fluoroanilino)thiophene-2-carboxylic acid
CID 113403969
2-(N-ethyl-3-fluoroanilino)-1,3-thiazole-5-carboxylic acid
CID 55112458
4-(4-aminophenyl)-N-ethyl-N-(3-methylphenyl)-1,3-thiazol-2-amine
CID 39131522
4-chloro-N-methyl-N-(3-methylphenyl)-1,3-thiazol-2-amine
CID 83156832
3-N-ethyl-3-N-(3-fluorophenyl)quinoxaline-2,3-diamine
CID 102985857

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine (CID 83157073) is 4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine is CCN(c1cccc(F)c1)c1nc(Cl)cs1.
What is the InChIKey of 4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine?
The InChIKey is FUGWIQMYPCQHCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClFN2S/c1-2-15(11-14-10(12)7-16-11)9-5-3-4-8(13)6-9/h3-7H,2H2,1H3.
What are the key properties of 4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine?
4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine has a molecular weight of 256.73 g/mol, XLogP of 4.09, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-ethyl-N-(3-fluorophenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 83157073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).