5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole

C74H69F15N12S6 — CID 157485855

IUPAC5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole
SMILESCC(C)C(C)c1sc(-c2cccnc2)nc1F.CC(C)C(C)c1sc(-c2cncc(F)c2)nc1F.CC(c1sc(-c2cccnc2)nc1F)C(F)(F)F.CC(c1sc(-c2cccnc2)nc1F)C1CC1.CC(c1sc(-c2cncc(F)c2)nc1F)C(F)(F)F.CC(c1sc(-c2cncc(F)c2)nc1F)C1CC1
InChIInChI=1S/C13H12F2N2S.C13H14F2N2S.C13H13FN2S.C13H15FN2S.C11H7F5N2S.C11H8F4N2S/c1-7(8-2-3-8)11-12(15)17-13(18-11)9-4-10(14)6-16-5-9;1-7(2)8(3)11-12(15)17-13(18-11)9-4-10(14)6-16-5-9;1-8(9-4-5-9)11-12(14)16-13(17-11)10-3-2-6-15-7-10;1-8(2)9(3)11-12(14)16-13(17-11)10-5-4-6-15-7-10;1-5(11(14,15)16)8-9(13)18-10(19-8)6-2-7(12)4-17-3-6;1-6(11(13,14)15)8-9(12)17-10(18-8)7-3-2-4-16-5-7/h4-8H,2-3H2,1H3;4-8H,1-3H3;2-3,6-9H,4-5H2,1H3;4-9H,1-3H3;2-5H,1H3;2-6H,1H3
InChIKeyBWRYJCVWUIYJIS-UHFFFAOYSA-N
MW1603.82 g/mol
LogP24.36
Rot. Bonds16

About 5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole

5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole (PubChem CID 157485855) has the molecular formula C74H69F15N12S6 and a molecular weight of 1603.82 g/mol. Its IUPAC name is 5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole.

Molecular Properties

Compound Name5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole
PubChem CID157485855
Molecular FormulaC74H69F15N12S6
Molecular Weight1603.82 g/mol
Exact Mass1602.39
IUPAC Name5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole
SMILESCC(C)C(C)c1sc(-c2cccnc2)nc1F.CC(C)C(C)c1sc(-c2cncc(F)c2)nc1F.CC(c1sc(-c2cccnc2)nc1F)C(F)(F)F.CC(c1sc(-c2cccnc2)nc1F)C1CC1.CC(c1sc(-c2cncc(F)c2)nc1F)C(F)(F)F.CC(c1sc(-c2cncc(F)c2)nc1F)C1CC1
InChIInChI=1S/C13H12F2N2S.C13H14F2N2S.C13H13FN2S.C13H15FN2S.C11H7F5N2S.C11H8F4N2S/c1-7(8-2-3-8)11-12(15)17-13(18-11)9-4-10(14)6-16-5-9;1-7(2)8(3)11-12(15)17-13(18-11)9-4-10(14)6-16-5-9;1-8(9-4-5-9)11-12(14)16-13(17-11)10-3-2-6-15-7-10;1-8(2)9(3)11-12(14)16-13(17-11)10-5-4-6-15-7-10;1-5(11(14,15)16)8-9(13)18-10(19-8)6-2-7(12)4-17-3-6;1-6(11(13,14)15)8-9(12)17-10(18-8)7-3-2-4-16-5-7/h4-8H,2-3H2,1H3;4-8H,1-3H3;2-3,6-9H,4-5H2,1H3;4-9H,1-3H3;2-5H,1H3;2-6H,1H3
InChIKeyBWRYJCVWUIYJIS-UHFFFAOYSA-N
XLogP24.36
TPSA154.68 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds16
Heavy Atoms107
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001603.82
LogP ≤ 524.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole?
The IUPAC name of 5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole (CID 157485855) is 5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole.
What is the SMILES notation for 5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole?
The canonical SMILES for 5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole is CC(C)C(C)c1sc(-c2cccnc2)nc1F.CC(C)C(C)c1sc(-c2cncc(F)c2)nc1F.CC(c1sc(-c2cccnc2)nc1F)C(F)(F)F.CC(c1sc(-c2cccnc2)nc1F)C1CC1.CC(c1sc(-c2cncc(F)c2)nc1F)C(F)(F)F.CC(c1sc(-c2cncc(F)c2)nc1F)C1CC1.
What is the InChIKey of 5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole?
The InChIKey is BWRYJCVWUIYJIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12F2N2S.C13H14F2N2S.C13H13FN2S.C13H15FN2S.C11H7F5N2S.C11H8F4N2S/c1-7(8-2-3-8)11-12(15)17-13(18-11)9-4-10(14)6-16-5-9;1-7(2)8(3)11-12(15)17-13(18-11)9-4-10(14)6-16-5-9;1-8(9-4-5-9)11-12(14)16-13(17-11)10-3-2-6-15-7-10;1-8(2)9(3)11-12(14)16-13(17-11)10-5-4-6-15-7-10;1-5(11(14,15)16)8-9(13)18-10(19-8)6-2-7(12)4-17-3-6;1-6(11(13,14)15)8-9(12)17-10(18-8)7-3-2-4-16-5-7/h4-8H,2-3H2,1H3;4-8H,1-3H3;2-3,6-9H,4-5H2,1H3;4-9H,1-3H3;2-5H,1H3;2-6H,1H3.
What are the key properties of 5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole?
5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole has a molecular weight of 1603.82 g/mol, XLogP of 24.36, 16 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-cyclopropylethyl)-4-fluoro-2-(5-fluoro-3-pyridinyl)-1,3-thiazole;5-(1-cyclopropylethyl)-4-fluoro-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(3-methylbutan-2-yl)-1,3-thiazole;4-fluoro-2-(5-fluoro-3-pyridinyl)-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole;4-fluoro-5-(3-methylbutan-2-yl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-2-pyridin-3-yl-5-(1,1,1-trifluoropropan-2-yl)-1,3-thiazole is sourced from PubChem (CID 157485855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).