5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide

C104H75Cl5F12N14O9S — CID 157110732

IUPAC5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCC(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)s1.COc1cc(OC)cc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c1.Cc1cccnc1-c1cc(NC(=O)c2ccc(C(F)(F)F)nc2C)ccc1Cl.Cc1nc(C(F)(F)F)ccc1C(=O)N(C(=O)c1ccc(C(F)(F)F)nc1C)c1ccc(Cl)c(-c2ccccn2)c1.Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc(Cl)c(-c2ccccn2)c1
InChIInChI=1S/C27H17ClF6N4O2.C20H15ClF3N3O.C20H17ClN2O3.C19H13ClF3N3O.C18H13ClN2O2S/c1-14-17(7-10-22(36-14)26(29,30)31)24(39)38(25(40)18-8-11-23(27(32,33)34)37-15(18)2)16-6-9-20(28)19(13-16)21-5-3-4-12-35-21;1-11-4-3-9-25-18(11)15-10-13(5-7-16(15)21)27-19(28)14-6-8-17(20(22,23)24)26-12(14)2;1-25-15-9-13(10-16(12-15)26-2)20(24)23-14-6-7-18(21)17(11-14)19-5-3-4-8-22-19;1-11-13(6-8-17(25-11)19(21,22)23)18(27)26-12-5-7-15(20)14(10-12)16-4-2-3-9-24-16;1-11(22)16-7-8-17(24-16)18(23)21-12-5-6-14(19)13(10-12)15-4-2-3-9-20-15/h3-13H,1-2H3;3-10H,1-2H3,(H,27,28);3-12H,1-2H3,(H,23,24);2-10H,1H3,(H,26,27);2-10H,1H3,(H,21,23)
InChIKeyAGUXWHMMWVCXBP-UHFFFAOYSA-N
MW2102.14 g/mol
LogP27.99
Rot. Bonds19

About 5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide

5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 157110732) has the molecular formula C104H75Cl5F12N14O9S and a molecular weight of 2102.14 g/mol. Its IUPAC name is 5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID157110732
Molecular FormulaC104H75Cl5F12N14O9S
Molecular Weight2102.14 g/mol
Exact Mass2098.38
IUPAC Name5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCC(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)s1.COc1cc(OC)cc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c1.Cc1cccnc1-c1cc(NC(=O)c2ccc(C(F)(F)F)nc2C)ccc1Cl.Cc1nc(C(F)(F)F)ccc1C(=O)N(C(=O)c1ccc(C(F)(F)F)nc1C)c1ccc(Cl)c(-c2ccccn2)c1.Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc(Cl)c(-c2ccccn2)c1
InChIInChI=1S/C27H17ClF6N4O2.C20H15ClF3N3O.C20H17ClN2O3.C19H13ClF3N3O.C18H13ClN2O2S/c1-14-17(7-10-22(36-14)26(29,30)31)24(39)38(25(40)18-8-11-23(27(32,33)34)37-15(18)2)16-6-9-20(28)19(13-16)21-5-3-4-12-35-21;1-11-4-3-9-25-18(11)15-10-13(5-7-16(15)21)27-19(28)14-6-8-17(20(22,23)24)26-12(14)2;1-25-15-9-13(10-16(12-15)26-2)20(24)23-14-6-7-18(21)17(11-14)19-5-3-4-8-22-19;1-11-13(6-8-17(25-11)19(21,22)23)18(27)26-12-5-7-15(20)14(10-12)16-4-2-3-9-24-16;1-11(22)16-7-8-17(24-16)18(23)21-12-5-6-14(19)13(10-12)15-4-2-3-9-20-15/h3-13H,1-2H3;3-10H,1-2H3,(H,27,28);3-12H,1-2H3,(H,23,24);2-10H,1H3,(H,26,27);2-10H,1H3,(H,21,23)
InChIKeyAGUXWHMMWVCXBP-UHFFFAOYSA-N
XLogP27.99
TPSA305.32 Ų
H-Bond Donors4
H-Bond Acceptors19
Rotatable Bonds19
Heavy Atoms145
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002102.14
LogP ≤ 527.99
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1019

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of 5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide (CID 157110732) is 5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for 5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide is CC(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)s1.COc1cc(OC)cc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c1.Cc1cccnc1-c1cc(NC(=O)c2ccc(C(F)(F)F)nc2C)ccc1Cl.Cc1nc(C(F)(F)F)ccc1C(=O)N(C(=O)c1ccc(C(F)(F)F)nc1C)c1ccc(Cl)c(-c2ccccn2)c1.Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc(Cl)c(-c2ccccn2)c1.
What is the InChIKey of 5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is AGUXWHMMWVCXBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H17ClF6N4O2.C20H15ClF3N3O.C20H17ClN2O3.C19H13ClF3N3O.C18H13ClN2O2S/c1-14-17(7-10-22(36-14)26(29,30)31)24(39)38(25(40)18-8-11-23(27(32,33)34)37-15(18)2)16-6-9-20(28)19(13-16)21-5-3-4-12-35-21;1-11-4-3-9-25-18(11)15-10-13(5-7-16(15)21)27-19(28)14-6-8-17(20(22,23)24)26-12(14)2;1-25-15-9-13(10-16(12-15)26-2)20(24)23-14-6-7-18(21)17(11-14)19-5-3-4-8-22-19;1-11-13(6-8-17(25-11)19(21,22)23)18(27)26-12-5-7-15(20)14(10-12)16-4-2-3-9-24-16;1-11(22)16-7-8-17(24-16)18(23)21-12-5-6-14(19)13(10-12)15-4-2-3-9-20-15/h3-13H,1-2H3;3-10H,1-2H3,(H,27,28);3-12H,1-2H3,(H,23,24);2-10H,1H3,(H,26,27);2-10H,1H3,(H,21,23).
What are the key properties of 5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide?
5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 2102.14 g/mol, XLogP of 27.99, 19 rotatable bonds, 4 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetyl-N-(4-chloro-3-pyridin-2-ylphenyl)thiophene-2-carboxamide;N-[4-chloro-3-(3-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]-6-(trifluoromethyl)pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 157110732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).