5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole

C79H129F3N12OS5 — CID 158865708

IUPAC5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole
SMILESCC(C)c1nc(CF)c(C2CC2)s1.CCc1c(C)c(C(C)C)nn1C.CCc1cc(C(C)C)nn1C.CCc1sc(C(C)C)nc1C.CCc1sc(C(C)C)nc1CF.Cc1cc(C(C)C)nn1C.Cc1nc(C(C)C)oc1C.Cc1nc(C(C)C)sc1C.Cc1sc(C(C)C)nc1CF
InChIInChI=1S/C10H14FNS.C10H18N2.C9H14FNS.C9H16N2.C9H15NS.C8H12FNS.C8H14N2.C8H13NO.C8H13NS/c1-6(2)10-12-8(5-11)9(13-10)7-3-4-7;1-6-9-8(4)10(7(2)3)11-12(9)5;1-4-8-7(5-10)11-9(12-8)6(2)3;1-5-8-6-9(7(2)3)10-11(8)4;1-5-8-7(4)10-9(11-8)6(2)3;1-5(2)8-10-7(4-9)6(3)11-8;1-6(2)8-5-7(3)10(4)9-8;2*1-5(2)8-9-6(3)7(4)10-8/h6-7H,3-5H2,1-2H3;7H,6H2,1-5H3;6H,4-5H2,1-3H3;6-7H,5H2,1-4H3;6H,5H2,1-4H3;5H,4H2,1-3H3;5-6H,1-4H3;2*5H,1-4H3
InChIKeyJBEYQLYZMIMQJG-UHFFFAOYSA-N
MW1480.31 g/mol
LogP24.76
Rot. Bonds17

About 5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole

5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole (PubChem CID 158865708) has the molecular formula C79H129F3N12OS5 and a molecular weight of 1480.31 g/mol. Its IUPAC name is 5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole.

Molecular Properties

Compound Name5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole
PubChem CID158865708
Molecular FormulaC79H129F3N12OS5
Molecular Weight1480.31 g/mol
Exact Mass1478.90
IUPAC Name5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole
SMILESCC(C)c1nc(CF)c(C2CC2)s1.CCc1c(C)c(C(C)C)nn1C.CCc1cc(C(C)C)nn1C.CCc1sc(C(C)C)nc1C.CCc1sc(C(C)C)nc1CF.Cc1cc(C(C)C)nn1C.Cc1nc(C(C)C)oc1C.Cc1nc(C(C)C)sc1C.Cc1sc(C(C)C)nc1CF
InChIInChI=1S/C10H14FNS.C10H18N2.C9H14FNS.C9H16N2.C9H15NS.C8H12FNS.C8H14N2.C8H13NO.C8H13NS/c1-6(2)10-12-8(5-11)9(13-10)7-3-4-7;1-6-9-8(4)10(7(2)3)11-12(9)5;1-4-8-7(5-10)11-9(12-8)6(2)3;1-5-8-6-9(7(2)3)10-11(8)4;1-5-8-7(4)10-9(11-8)6(2)3;1-5(2)8-10-7(4-9)6(3)11-8;1-6(2)8-5-7(3)10(4)9-8;2*1-5(2)8-9-6(3)7(4)10-8/h6-7H,3-5H2,1-2H3;7H,6H2,1-5H3;6H,4-5H2,1-3H3;6-7H,5H2,1-4H3;6H,5H2,1-4H3;5H,4H2,1-3H3;5-6H,1-4H3;2*5H,1-4H3
InChIKeyJBEYQLYZMIMQJG-UHFFFAOYSA-N
XLogP24.76
TPSA143.94 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds17
Heavy Atoms100
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001480.31
LogP ≤ 524.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole?
The IUPAC name of 5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole (CID 158865708) is 5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole.
What is the SMILES notation for 5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole?
The canonical SMILES for 5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole is CC(C)c1nc(CF)c(C2CC2)s1.CCc1c(C)c(C(C)C)nn1C.CCc1cc(C(C)C)nn1C.CCc1sc(C(C)C)nc1C.CCc1sc(C(C)C)nc1CF.Cc1cc(C(C)C)nn1C.Cc1nc(C(C)C)oc1C.Cc1nc(C(C)C)sc1C.Cc1sc(C(C)C)nc1CF.
What is the InChIKey of 5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole?
The InChIKey is JBEYQLYZMIMQJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNS.C10H18N2.C9H14FNS.C9H16N2.C9H15NS.C8H12FNS.C8H14N2.C8H13NO.C8H13NS/c1-6(2)10-12-8(5-11)9(13-10)7-3-4-7;1-6-9-8(4)10(7(2)3)11-12(9)5;1-4-8-7(5-10)11-9(12-8)6(2)3;1-5-8-6-9(7(2)3)10-11(8)4;1-5-8-7(4)10-9(11-8)6(2)3;1-5(2)8-10-7(4-9)6(3)11-8;1-6(2)8-5-7(3)10(4)9-8;2*1-5(2)8-9-6(3)7(4)10-8/h6-7H,3-5H2,1-2H3;7H,6H2,1-5H3;6H,4-5H2,1-3H3;6-7H,5H2,1-4H3;6H,5H2,1-4H3;5H,4H2,1-3H3;5-6H,1-4H3;2*5H,1-4H3.
What are the key properties of 5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole?
5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole has a molecular weight of 1480.31 g/mol, XLogP of 24.76, 17 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-1,4-dimethyl-3-propan-2-ylpyrazole;5-ethyl-4-(fluoromethyl)-2-propan-2-yl-1,3-thiazole;5-ethyl-1-methyl-3-propan-2-ylpyrazole;5-ethyl-4-methyl-2-propan-2-yl-1,3-thiazole;4-(fluoromethyl)-5-methyl-2-propan-2-yl-1,3-thiazole is sourced from PubChem (CID 158865708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).