2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide

C119H116F2N12O15S8 — CID 158574409

IUPAC2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide
SMILESCCc1nc(-c2ccc(NC(=O)c3ccc(OC)cc3C)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(OC)cc3CC)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(OC)cc3F)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(OC)cc3OC)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(S(C)(=O)=O)cc3C)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(S(C)(=O)=O)cc3F)cc2)cs1
InChIInChI=1S/C21H22N2O2S.C20H20N2O3S2.C20H20N2O3S.C20H20N2O2S.C19H17FN2O3S2.C19H17FN2O2S/c1-4-14-12-17(25-3)10-11-18(14)21(24)22-16-8-6-15(7-9-16)19-13-26-20(5-2)23-19;1-4-19-22-18(12-26-19)14-5-7-15(8-6-14)21-20(23)17-10-9-16(11-13(17)2)27(3,24)25;1-4-19-22-17(12-26-19)13-5-7-14(8-6-13)21-20(23)16-10-9-15(24-2)11-18(16)25-3;1-4-19-22-18(12-25-19)14-5-7-15(8-6-14)21-20(23)17-10-9-16(24-3)11-13(17)2;1-3-18-22-17(11-26-18)12-4-6-13(7-5-12)21-19(23)15-9-8-14(10-16(15)20)27(2,24)25;1-3-18-22-17(11-25-18)12-4-6-13(7-5-12)21-19(23)15-9-8-14(24-2)10-16(15)20/h6-13H,4-5H2,1-3H3,(H,22,24);5-12H,4H2,1-3H3,(H,21,23);5-12H,4H2,1-3H3,(H,21,23);5-12H,4H2,1-3H3,(H,21,23);4-11H,3H2,1-2H3,(H,21,23);4-11H,3H2,1-2H3,(H,21,23)
InChIKeyHSMDIJFUVAWLOK-UHFFFAOYSA-N
MW2248.84 g/mol
LogP28.06
Rot. Bonds32

About 2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide

2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide (PubChem CID 158574409) has the molecular formula C119H116F2N12O15S8 and a molecular weight of 2248.84 g/mol. Its IUPAC name is 2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide.

Molecular Properties

Compound Name2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide
PubChem CID158574409
Molecular FormulaC119H116F2N12O15S8
Molecular Weight2248.84 g/mol
Exact Mass2246.64
IUPAC Name2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide
SMILESCCc1nc(-c2ccc(NC(=O)c3ccc(OC)cc3C)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(OC)cc3CC)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(OC)cc3F)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(OC)cc3OC)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(S(C)(=O)=O)cc3C)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(S(C)(=O)=O)cc3F)cc2)cs1
InChIInChI=1S/C21H22N2O2S.C20H20N2O3S2.C20H20N2O3S.C20H20N2O2S.C19H17FN2O3S2.C19H17FN2O2S/c1-4-14-12-17(25-3)10-11-18(14)21(24)22-16-8-6-15(7-9-16)19-13-26-20(5-2)23-19;1-4-19-22-18(12-26-19)14-5-7-15(8-6-14)21-20(23)17-10-9-16(11-13(17)2)27(3,24)25;1-4-19-22-17(12-26-19)13-5-7-14(8-6-13)21-20(23)16-10-9-15(24-2)11-18(16)25-3;1-4-19-22-18(12-25-19)14-5-7-15(8-6-14)21-20(23)17-10-9-16(24-3)11-13(17)2;1-3-18-22-17(11-26-18)12-4-6-13(7-5-12)21-19(23)15-9-8-14(10-16(15)20)27(2,24)25;1-3-18-22-17(11-25-18)12-4-6-13(7-5-12)21-19(23)15-9-8-14(24-2)10-16(15)20/h6-13H,4-5H2,1-3H3,(H,22,24);5-12H,4H2,1-3H3,(H,21,23);5-12H,4H2,1-3H3,(H,21,23);5-12H,4H2,1-3H3,(H,21,23);4-11H,3H2,1-2H3,(H,21,23);4-11H,3H2,1-2H3,(H,21,23)
InChIKeyHSMDIJFUVAWLOK-UHFFFAOYSA-N
XLogP28.06
TPSA366.37 Ų
H-Bond Donors6
H-Bond Acceptors27
Rotatable Bonds32
Heavy Atoms156
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002248.84
LogP ≤ 528.06
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1027

Analyze 2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide?
The IUPAC name of 2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide (CID 158574409) is 2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide.
What is the SMILES notation for 2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide?
The canonical SMILES for 2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide is CCc1nc(-c2ccc(NC(=O)c3ccc(OC)cc3C)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(OC)cc3CC)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(OC)cc3F)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(OC)cc3OC)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(S(C)(=O)=O)cc3C)cc2)cs1.CCc1nc(-c2ccc(NC(=O)c3ccc(S(C)(=O)=O)cc3F)cc2)cs1.
What is the InChIKey of 2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide?
The InChIKey is HSMDIJFUVAWLOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O2S.C20H20N2O3S2.C20H20N2O3S.C20H20N2O2S.C19H17FN2O3S2.C19H17FN2O2S/c1-4-14-12-17(25-3)10-11-18(14)21(24)22-16-8-6-15(7-9-16)19-13-26-20(5-2)23-19;1-4-19-22-18(12-26-19)14-5-7-15(8-6-14)21-20(23)17-10-9-16(11-13(17)2)27(3,24)25;1-4-19-22-17(12-26-19)13-5-7-14(8-6-13)21-20(23)16-10-9-15(24-2)11-18(16)25-3;1-4-19-22-18(12-25-19)14-5-7-15(8-6-14)21-20(23)17-10-9-16(24-3)11-13(17)2;1-3-18-22-17(11-26-18)12-4-6-13(7-5-12)21-19(23)15-9-8-14(10-16(15)20)27(2,24)25;1-3-18-22-17(11-25-18)12-4-6-13(7-5-12)21-19(23)15-9-8-14(24-2)10-16(15)20/h6-13H,4-5H2,1-3H3,(H,22,24);5-12H,4H2,1-3H3,(H,21,23);5-12H,4H2,1-3H3,(H,21,23);5-12H,4H2,1-3H3,(H,21,23);4-11H,3H2,1-2H3,(H,21,23);4-11H,3H2,1-2H3,(H,21,23).
What are the key properties of 2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide?
2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide has a molecular weight of 2248.84 g/mol, XLogP of 28.06, 32 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2,4-dimethoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methoxybenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-fluoro-4-methylsulfonylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-4-methoxy-2-methylbenzamide;N-[4-(2-ethyl-1,3-thiazol-4-yl)phenyl]-2-methyl-4-methylsulfonylbenzamide is sourced from PubChem (CID 158574409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).