2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide

C109H80Cl2F21N23O6 — CID 161182065

IUPAC2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide
SMILESCCc1cc(-c2ccc(NC(=O)c3ccccc3Cl)nc2F)n(CC)n1.Cc1ccc(C(=O)Nc2ncc(-c3cc(C(F)(F)F)nn3C)cc2F)cc1.Cn1c(-c2ccc(NC(=O)c3ccccc3)nc2F)cc2ccccc21.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2c(F)cccc2F)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccccc2Cl)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccccc2F)c(F)c1
InChIInChI=1S/C21H16FN3O.C19H18ClFN4O.C18H14F4N4O.C17H11ClF4N4O.C17H10F6N4O.C17H11F5N4O/c1-25-17-10-6-5-9-15(17)13-18(25)16-11-12-19(23-20(16)22)24-21(26)14-7-3-2-4-8-14;1-3-12-11-16(25(4-2)24-12)14-9-10-17(22-18(14)21)23-19(26)13-7-5-6-8-15(13)20;1-10-3-5-11(6-4-10)17(27)24-16-13(19)7-12(9-23-16)14-8-15(18(20,21)22)25-26(14)2;1-26-13(7-14(25-26)17(20,21)22)9-6-12(19)15(23-8-9)24-16(27)10-4-2-3-5-11(10)18;1-27-12(6-13(26-27)17(21,22)23)8-5-11(20)15(24-7-8)25-16(28)14-9(18)3-2-4-10(14)19;1-26-13(7-14(25-26)17(20,21)22)9-6-12(19)15(23-8-9)24-16(27)10-4-2-3-5-11(10)18/h2-13H,1H3,(H,23,24,26);5-11H,3-4H2,1-2H3,(H,22,23,26);3-9H,1-2H3,(H,23,24,27);2-8H,1H3,(H,23,24,27);2-7H,1H3,(H,24,25,28);2-8H,1H3,(H,23,24,27)
InChIKeyUSPAPASZBFVHSY-UHFFFAOYSA-N
MW2277.86 g/mol
LogP26.15
Rot. Bonds20

About 2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide

2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide (PubChem CID 161182065) has the molecular formula C109H80Cl2F21N23O6 and a molecular weight of 2277.86 g/mol. Its IUPAC name is 2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide.

Molecular Properties

Compound Name2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide
PubChem CID161182065
Molecular FormulaC109H80Cl2F21N23O6
Molecular Weight2277.86 g/mol
Exact Mass2275.57
IUPAC Name2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide
SMILESCCc1cc(-c2ccc(NC(=O)c3ccccc3Cl)nc2F)n(CC)n1.Cc1ccc(C(=O)Nc2ncc(-c3cc(C(F)(F)F)nn3C)cc2F)cc1.Cn1c(-c2ccc(NC(=O)c3ccccc3)nc2F)cc2ccccc21.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2c(F)cccc2F)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccccc2Cl)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccccc2F)c(F)c1
InChIInChI=1S/C21H16FN3O.C19H18ClFN4O.C18H14F4N4O.C17H11ClF4N4O.C17H10F6N4O.C17H11F5N4O/c1-25-17-10-6-5-9-15(17)13-18(25)16-11-12-19(23-20(16)22)24-21(26)14-7-3-2-4-8-14;1-3-12-11-16(25(4-2)24-12)14-9-10-17(22-18(14)21)23-19(26)13-7-5-6-8-15(13)20;1-10-3-5-11(6-4-10)17(27)24-16-13(19)7-12(9-23-16)14-8-15(18(20,21)22)25-26(14)2;1-26-13(7-14(25-26)17(20,21)22)9-6-12(19)15(23-8-9)24-16(27)10-4-2-3-5-11(10)18;1-27-12(6-13(26-27)17(21,22)23)8-5-11(20)15(24-7-8)25-16(28)14-9(18)3-2-4-10(14)19;1-26-13(7-14(25-26)17(20,21)22)9-6-12(19)15(23-8-9)24-16(27)10-4-2-3-5-11(10)18/h2-13H,1H3,(H,23,24,26);5-11H,3-4H2,1-2H3,(H,22,23,26);3-9H,1-2H3,(H,23,24,27);2-8H,1H3,(H,23,24,27);2-7H,1H3,(H,24,25,28);2-8H,1H3,(H,23,24,27)
InChIKeyUSPAPASZBFVHSY-UHFFFAOYSA-N
XLogP26.15
TPSA345.97 Ų
H-Bond Donors6
H-Bond Acceptors23
Rotatable Bonds20
Heavy Atoms161
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002277.86
LogP ≤ 526.15
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide with MolForge

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

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide?
The IUPAC name of 2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide (CID 161182065) is 2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide.
What is the SMILES notation for 2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide?
The canonical SMILES for 2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide is CCc1cc(-c2ccc(NC(=O)c3ccccc3Cl)nc2F)n(CC)n1.Cc1ccc(C(=O)Nc2ncc(-c3cc(C(F)(F)F)nn3C)cc2F)cc1.Cn1c(-c2ccc(NC(=O)c3ccccc3)nc2F)cc2ccccc21.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2c(F)cccc2F)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccccc2Cl)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccccc2F)c(F)c1.
What is the InChIKey of 2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide?
The InChIKey is USPAPASZBFVHSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16FN3O.C19H18ClFN4O.C18H14F4N4O.C17H11ClF4N4O.C17H10F6N4O.C17H11F5N4O/c1-25-17-10-6-5-9-15(17)13-18(25)16-11-12-19(23-20(16)22)24-21(26)14-7-3-2-4-8-14;1-3-12-11-16(25(4-2)24-12)14-9-10-17(22-18(14)21)23-19(26)13-7-5-6-8-15(13)20;1-10-3-5-11(6-4-10)17(27)24-16-13(19)7-12(9-23-16)14-8-15(18(20,21)22)25-26(14)2;1-26-13(7-14(25-26)17(20,21)22)9-6-12(19)15(23-8-9)24-16(27)10-4-2-3-5-11(10)18;1-27-12(6-13(26-27)17(21,22)23)8-5-11(20)15(24-7-8)25-16(28)14-9(18)3-2-4-10(14)19;1-26-13(7-14(25-26)17(20,21)22)9-6-12(19)15(23-8-9)24-16(27)10-4-2-3-5-11(10)18/h2-13H,1H3,(H,23,24,26);5-11H,3-4H2,1-2H3,(H,22,23,26);3-9H,1-2H3,(H,23,24,27);2-8H,1H3,(H,23,24,27);2-7H,1H3,(H,24,25,28);2-8H,1H3,(H,23,24,27).
What are the key properties of 2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide?
2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide has a molecular weight of 2277.86 g/mol, XLogP of 26.15, 20 rotatable bonds, 6 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[5-(1,3-diethylpyrazol-5-yl)-6-fluoro-2-pyridinyl]benzamide;2-chloro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-fluoro-5-(1-methylindol-2-yl)-2-pyridinyl]benzamide;N-[3-fluoro-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide is sourced from PubChem (CID 161182065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).