3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide

C94H95N23O7S — CID 159275046

IUPAC3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide
SMILESCC(=O)Nc1ncc(-n2cc(-c3cc(C(=O)NC4CC4)ccc3C)cn2)s1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cnc3ccc(C(=O)N4CCCCC4)cn23)c1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cnc3ccc(C(=O)N4CCN(C)CC4)cn23)c1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cnc3ccccn23)c1
InChIInChI=1S/C27H29N7O2.C27H28N6O2.C21H19N5O.C19H19N5O2S/c1-18-3-4-19(26(35)30-22-6-7-22)13-23(18)21-14-29-34(17-21)25-15-28-24-8-5-20(16-33(24)25)27(36)32-11-9-31(2)10-12-32;1-18-5-6-19(26(34)30-22-8-9-22)13-23(18)21-14-29-33(17-21)25-15-28-24-10-7-20(16-32(24)25)27(35)31-11-3-2-4-12-31;1-14-5-6-15(21(27)24-17-7-8-17)10-18(14)16-11-23-26(13-16)20-12-22-19-4-2-3-9-25(19)20;1-11-3-4-13(18(26)23-15-5-6-15)7-16(11)14-8-21-24(10-14)17-9-20-19(27-17)22-12(2)25/h3-5,8,13-17,22H,6-7,9-12H2,1-2H3,(H,30,35);5-7,10,13-17,22H,2-4,8-9,11-12H2,1H3,(H,30,34);2-6,9-13,17H,7-8H2,1H3,(H,24,27);3-4,7-10,15H,5-6H2,1-2H3,(H,23,26)(H,20,22,25)
InChIKeyKYEYDLHMFNWZPU-UHFFFAOYSA-N
MW1691.01 g/mol
LogP13.33
Rot. Bonds19

About 3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide

3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide (PubChem CID 159275046) has the molecular formula C94H95N23O7S and a molecular weight of 1691.01 g/mol. Its IUPAC name is 3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide.

Molecular Properties

Compound Name3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide
PubChem CID159275046
Molecular FormulaC94H95N23O7S
Molecular Weight1691.01 g/mol
Exact Mass1689.75
IUPAC Name3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide
SMILESCC(=O)Nc1ncc(-n2cc(-c3cc(C(=O)NC4CC4)ccc3C)cn2)s1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cnc3ccc(C(=O)N4CCCCC4)cn23)c1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cnc3ccc(C(=O)N4CCN(C)CC4)cn23)c1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cnc3ccccn23)c1
InChIInChI=1S/C27H29N7O2.C27H28N6O2.C21H19N5O.C19H19N5O2S/c1-18-3-4-19(26(35)30-22-6-7-22)13-23(18)21-14-29-34(17-21)25-15-28-24-8-5-20(16-33(24)25)27(36)32-11-9-31(2)10-12-32;1-18-5-6-19(26(34)30-22-8-9-22)13-23(18)21-14-29-33(17-21)25-15-28-24-10-7-20(16-32(24)25)27(35)31-11-3-2-4-12-31;1-14-5-6-15(21(27)24-17-7-8-17)10-18(14)16-11-23-26(13-16)20-12-22-19-4-2-3-9-25(19)20;1-11-3-4-13(18(26)23-15-5-6-15)7-16(11)14-8-21-24(10-14)17-9-20-19(27-17)22-12(2)25/h3-5,8,13-17,22H,6-7,9-12H2,1-2H3,(H,30,35);5-7,10,13-17,22H,2-4,8-9,11-12H2,1H3,(H,30,34);2-6,9-13,17H,7-8H2,1H3,(H,24,27);3-4,7-10,15H,5-6H2,1-2H3,(H,23,26)(H,20,22,25)
InChIKeyKYEYDLHMFNWZPU-UHFFFAOYSA-N
XLogP13.33
TPSA325.43 Ų
H-Bond Donors5
H-Bond Acceptors24
Rotatable Bonds19
Heavy Atoms125
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001691.01
LogP ≤ 513.33
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1024

Analyze 3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide 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 3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide?
The IUPAC name of 3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide (CID 159275046) is 3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide.
What is the SMILES notation for 3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide?
The canonical SMILES for 3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide is CC(=O)Nc1ncc(-n2cc(-c3cc(C(=O)NC4CC4)ccc3C)cn2)s1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cnc3ccc(C(=O)N4CCCCC4)cn23)c1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cnc3ccc(C(=O)N4CCN(C)CC4)cn23)c1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cnc3ccccn23)c1.
What is the InChIKey of 3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide?
The InChIKey is KYEYDLHMFNWZPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H29N7O2.C27H28N6O2.C21H19N5O.C19H19N5O2S/c1-18-3-4-19(26(35)30-22-6-7-22)13-23(18)21-14-29-34(17-21)25-15-28-24-8-5-20(16-33(24)25)27(36)32-11-9-31(2)10-12-32;1-18-5-6-19(26(34)30-22-8-9-22)13-23(18)21-14-29-33(17-21)25-15-28-24-10-7-20(16-32(24)25)27(35)31-11-3-2-4-12-31;1-14-5-6-15(21(27)24-17-7-8-17)10-18(14)16-11-23-26(13-16)20-12-22-19-4-2-3-9-25(19)20;1-11-3-4-13(18(26)23-15-5-6-15)7-16(11)14-8-21-24(10-14)17-9-20-19(27-17)22-12(2)25/h3-5,8,13-17,22H,6-7,9-12H2,1-2H3,(H,30,35);5-7,10,13-17,22H,2-4,8-9,11-12H2,1H3,(H,30,34);2-6,9-13,17H,7-8H2,1H3,(H,24,27);3-4,7-10,15H,5-6H2,1-2H3,(H,23,26)(H,20,22,25).
What are the key properties of 3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide?
3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide has a molecular weight of 1691.01 g/mol, XLogP of 13.33, 19 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(2-acetamido-1,3-thiazol-5-yl)pyrazol-4-yl]-N-cyclopropyl-4-methylbenzamide;N-cyclopropyl-3-(1-imidazo[1,2-a]pyridin-3-ylpyrazol-4-yl)-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[6-(4-methylpiperazine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-4-methyl-3-[1-[6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide is sourced from PubChem (CID 159275046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).