4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine

C64H57Br6F9N16S6 — CID 158261475

IUPAC4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine
SMILESCCN(C)c1sc(-c2cccnc2)nc1Br.CCN(C)c1sc(-c2cncc(F)c2)nc1Br.CCc1sc(-c2cccnc2)nc1Br.CCc1sc(-c2cncc(F)c2)nc1Br.CN(CC(F)(F)F)c1sc(-c2cccnc2)nc1Br.CN(CC(F)(F)F)c1sc(-c2cncc(F)c2)nc1Br
InChIInChI=1S/C11H8BrF4N3S.C11H9BrF3N3S.C11H11BrFN3S.C11H12BrN3S.C10H8BrFN2S.C10H9BrN2S/c1-19(5-11(14,15)16)10-8(12)18-9(20-10)6-2-7(13)4-17-3-6;1-18(6-11(13,14)15)10-8(12)17-9(19-10)7-3-2-4-16-5-7;1-3-16(2)11-9(12)15-10(17-11)7-4-8(13)6-14-5-7;1-3-15(2)11-9(12)14-10(16-11)8-5-4-6-13-7-8;1-2-8-9(11)14-10(15-8)6-3-7(12)5-13-4-6;1-2-8-9(11)13-10(14-8)7-4-3-5-12-6-7/h2-4H,5H2,1H3;2-5H,6H2,1H3;4-6H,3H2,1-2H3;4-7H,3H2,1-2H3;3-5H,2H2,1H3;3-6H,2H2,1H3
InChIKeyGHXNNWPYFKQIRJ-UHFFFAOYSA-N
MW1893.08 g/mol
LogP22.26
Rot. Bonds16

About 4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine

4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine (PubChem CID 158261475) has the molecular formula C64H57Br6F9N16S6 and a molecular weight of 1893.08 g/mol. Its IUPAC name is 4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine.

Molecular Properties

Compound Name4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine
PubChem CID158261475
Molecular FormulaC64H57Br6F9N16S6
Molecular Weight1893.08 g/mol
Exact Mass1885.82
IUPAC Name4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine
SMILESCCN(C)c1sc(-c2cccnc2)nc1Br.CCN(C)c1sc(-c2cncc(F)c2)nc1Br.CCc1sc(-c2cccnc2)nc1Br.CCc1sc(-c2cncc(F)c2)nc1Br.CN(CC(F)(F)F)c1sc(-c2cccnc2)nc1Br.CN(CC(F)(F)F)c1sc(-c2cncc(F)c2)nc1Br
InChIInChI=1S/C11H8BrF4N3S.C11H9BrF3N3S.C11H11BrFN3S.C11H12BrN3S.C10H8BrFN2S.C10H9BrN2S/c1-19(5-11(14,15)16)10-8(12)18-9(20-10)6-2-7(13)4-17-3-6;1-18(6-11(13,14)15)10-8(12)17-9(19-10)7-3-2-4-16-5-7;1-3-16(2)11-9(12)15-10(17-11)7-4-8(13)6-14-5-7;1-3-15(2)11-9(12)14-10(16-11)8-5-4-6-13-7-8;1-2-8-9(11)14-10(15-8)6-3-7(12)5-13-4-6;1-2-8-9(11)13-10(14-8)7-4-3-5-12-6-7/h2-4H,5H2,1H3;2-5H,6H2,1H3;4-6H,3H2,1-2H3;4-7H,3H2,1-2H3;3-5H,2H2,1H3;3-6H,2H2,1H3
InChIKeyGHXNNWPYFKQIRJ-UHFFFAOYSA-N
XLogP22.26
TPSA167.64 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds16
Heavy Atoms101
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001893.08
LogP ≤ 522.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Analyze 4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine?
The IUPAC name of 4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine (CID 158261475) is 4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine.
What is the SMILES notation for 4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine?
The canonical SMILES for 4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine is CCN(C)c1sc(-c2cccnc2)nc1Br.CCN(C)c1sc(-c2cncc(F)c2)nc1Br.CCc1sc(-c2cccnc2)nc1Br.CCc1sc(-c2cncc(F)c2)nc1Br.CN(CC(F)(F)F)c1sc(-c2cccnc2)nc1Br.CN(CC(F)(F)F)c1sc(-c2cncc(F)c2)nc1Br.
What is the InChIKey of 4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine?
The InChIKey is GHXNNWPYFKQIRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrF4N3S.C11H9BrF3N3S.C11H11BrFN3S.C11H12BrN3S.C10H8BrFN2S.C10H9BrN2S/c1-19(5-11(14,15)16)10-8(12)18-9(20-10)6-2-7(13)4-17-3-6;1-18(6-11(13,14)15)10-8(12)17-9(19-10)7-3-2-4-16-5-7;1-3-16(2)11-9(12)15-10(17-11)7-4-8(13)6-14-5-7;1-3-15(2)11-9(12)14-10(16-11)8-5-4-6-13-7-8;1-2-8-9(11)14-10(15-8)6-3-7(12)5-13-4-6;1-2-8-9(11)13-10(14-8)7-4-3-5-12-6-7/h2-4H,5H2,1H3;2-5H,6H2,1H3;4-6H,3H2,1-2H3;4-7H,3H2,1-2H3;3-5H,2H2,1H3;3-6H,2H2,1H3.
What are the key properties of 4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine?
4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine has a molecular weight of 1893.08 g/mol, XLogP of 22.26, 16 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-ethyl-2-(5-fluoro-3-pyridinyl)-N-methyl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;4-bromo-N-ethyl-N-methyl-2-pyridin-3-yl-1,3-thiazol-5-amine;4-bromo-5-ethyl-2-pyridin-3-yl-1,3-thiazole;4-bromo-2-(5-fluoro-3-pyridinyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine;4-bromo-N-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-5-amine is sourced from PubChem (CID 158261475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).