5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide

C105H137N41O16S — CID 157099716

IUPAC5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide
SMILESCC(=O)Nc1c(-c2nc3ccccc3s2)c(C(=O)Nc2ccccc2)nn1-c1ccc(C)cc1.CC(=O)Nc1cc(C(=O)Nc2cc(C(C)=O)nn2C)nn1C.CC(=O)Nc1cc(C(=O)Nc2cc(C)nn2C)nn1C.CCCNC(=O)c1cc(NC(=O)c2cc(NC(=O)CCN(C)C)n(C)n2)n(C)n1.CCCNC(=O)c1cc(NC(=O)c2cc(NC(=O)CCN(C)C)n(C)n2)nn1C.CCCNC(=O)c1cc(NC(=O)c2cc(NC(=O)CCN(C)C)nn2C)n(C)n1
InChIInChI=1S/C26H21N5O2S.3C18H28N8O3.C13H16N6O3.C12H16N6O2/c1-16-12-14-19(15-13-16)31-24(27-17(2)32)22(26-29-20-10-6-7-11-21(20)34-26)23(30-31)25(33)28-18-8-4-3-5-9-18;1-6-8-19-18(29)13-11-14(23-25(13)4)20-17(28)12-10-15(26(5)22-12)21-16(27)7-9-24(2)3;1-6-8-19-17(28)12-10-15(26(5)22-12)21-18(29)13-11-14(23-25(13)4)20-16(27)7-9-24(2)3;1-6-8-19-17(28)12-10-15(26(5)22-12)21-18(29)13-11-14(25(4)23-13)20-16(27)7-9-24(2)3;1-7(20)9-5-12(19(4)16-9)15-13(22)10-6-11(14-8(2)21)18(3)17-10;1-7-5-10(17(3)15-7)14-12(20)9-6-11(13-8(2)19)18(4)16-9/h3-15H,1-2H3,(H,27,32)(H,28,33);10-11H,6-9H2,1-5H3,(H,19,29)(H,21,27)(H,20,23,28);10-11H,6-9H2,1-5H3,(H,19,28)(H,21,29)(H,20,23,27);10-11H,6-9H2,1-5H3,(H,19,28)(H,20,27)(H,21,29);5-6H,1-4H3,(H,14,21)(H,15,22);5-6H,1-4H3,(H,13,19)(H,14,20)
InChIKeyAFPWURVYHIDZNX-UHFFFAOYSA-N
MW2261.59 g/mol
LogP8.22
Rot. Bonds39

About 5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide

5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide (PubChem CID 157099716) has the molecular formula C105H137N41O16S and a molecular weight of 2261.59 g/mol. Its IUPAC name is 5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide.

Molecular Properties

Compound Name5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide
PubChem CID157099716
Molecular FormulaC105H137N41O16S
Molecular Weight2261.59 g/mol
Exact Mass2260.09
IUPAC Name5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide
SMILESCC(=O)Nc1c(-c2nc3ccccc3s2)c(C(=O)Nc2ccccc2)nn1-c1ccc(C)cc1.CC(=O)Nc1cc(C(=O)Nc2cc(C(C)=O)nn2C)nn1C.CC(=O)Nc1cc(C(=O)Nc2cc(C)nn2C)nn1C.CCCNC(=O)c1cc(NC(=O)c2cc(NC(=O)CCN(C)C)n(C)n2)n(C)n1.CCCNC(=O)c1cc(NC(=O)c2cc(NC(=O)CCN(C)C)n(C)n2)nn1C.CCCNC(=O)c1cc(NC(=O)c2cc(NC(=O)CCN(C)C)nn2C)n(C)n1
InChIInChI=1S/C26H21N5O2S.3C18H28N8O3.C13H16N6O3.C12H16N6O2/c1-16-12-14-19(15-13-16)31-24(27-17(2)32)22(26-29-20-10-6-7-11-21(20)34-26)23(30-31)25(33)28-18-8-4-3-5-9-18;1-6-8-19-18(29)13-11-14(23-25(13)4)20-17(28)12-10-15(26(5)22-12)21-16(27)7-9-24(2)3;1-6-8-19-17(28)12-10-15(26(5)22-12)21-18(29)13-11-14(23-25(13)4)20-16(27)7-9-24(2)3;1-6-8-19-17(28)12-10-15(26(5)22-12)21-18(29)13-11-14(25(4)23-13)20-16(27)7-9-24(2)3;1-7(20)9-5-12(19(4)16-9)15-13(22)10-6-11(14-8(2)21)18(3)17-10;1-7-5-10(17(3)15-7)14-12(20)9-6-11(13-8(2)19)18(4)16-9/h3-15H,1-2H3,(H,27,32)(H,28,33);10-11H,6-9H2,1-5H3,(H,19,29)(H,21,27)(H,20,23,28);10-11H,6-9H2,1-5H3,(H,19,28)(H,21,29)(H,20,23,27);10-11H,6-9H2,1-5H3,(H,19,28)(H,20,27)(H,21,29);5-6H,1-4H3,(H,14,21)(H,15,22);5-6H,1-4H3,(H,13,19)(H,14,20)
InChIKeyAFPWURVYHIDZNX-UHFFFAOYSA-N
XLogP8.22
TPSA672.20 Ų
H-Bond Donors15
H-Bond Acceptors43
Rotatable Bonds39
Heavy Atoms163
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002261.59
LogP ≤ 58.22
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1043

Analyze 5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide?
The IUPAC name of 5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide (CID 157099716) is 5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide.
What is the SMILES notation for 5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide?
The canonical SMILES for 5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide is CC(=O)Nc1c(-c2nc3ccccc3s2)c(C(=O)Nc2ccccc2)nn1-c1ccc(C)cc1.CC(=O)Nc1cc(C(=O)Nc2cc(C(C)=O)nn2C)nn1C.CC(=O)Nc1cc(C(=O)Nc2cc(C)nn2C)nn1C.CCCNC(=O)c1cc(NC(=O)c2cc(NC(=O)CCN(C)C)n(C)n2)n(C)n1.CCCNC(=O)c1cc(NC(=O)c2cc(NC(=O)CCN(C)C)n(C)n2)nn1C.CCCNC(=O)c1cc(NC(=O)c2cc(NC(=O)CCN(C)C)nn2C)n(C)n1.
What is the InChIKey of 5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide?
The InChIKey is AFPWURVYHIDZNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21N5O2S.3C18H28N8O3.C13H16N6O3.C12H16N6O2/c1-16-12-14-19(15-13-16)31-24(27-17(2)32)22(26-29-20-10-6-7-11-21(20)34-26)23(30-31)25(33)28-18-8-4-3-5-9-18;1-6-8-19-18(29)13-11-14(23-25(13)4)20-17(28)12-10-15(26(5)22-12)21-16(27)7-9-24(2)3;1-6-8-19-17(28)12-10-15(26(5)22-12)21-18(29)13-11-14(23-25(13)4)20-16(27)7-9-24(2)3;1-6-8-19-17(28)12-10-15(26(5)22-12)21-18(29)13-11-14(25(4)23-13)20-16(27)7-9-24(2)3;1-7(20)9-5-12(19(4)16-9)15-13(22)10-6-11(14-8(2)21)18(3)17-10;1-7-5-10(17(3)15-7)14-12(20)9-6-11(13-8(2)19)18(4)16-9/h3-15H,1-2H3,(H,27,32)(H,28,33);10-11H,6-9H2,1-5H3,(H,19,29)(H,21,27)(H,20,23,28);10-11H,6-9H2,1-5H3,(H,19,28)(H,21,29)(H,20,23,27);10-11H,6-9H2,1-5H3,(H,19,28)(H,20,27)(H,21,29);5-6H,1-4H3,(H,14,21)(H,15,22);5-6H,1-4H3,(H,13,19)(H,14,20).
What are the key properties of 5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide?
5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide has a molecular weight of 2261.59 g/mol, XLogP of 8.22, 39 rotatable bonds, 15 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetamido-N-(3-acetyl-1-methylpyrazol-5-yl)-1-methylpyrazole-3-carboxamide;5-acetamido-4-(1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-N-phenylpyrazole-3-carboxamide;5-acetamido-N-(2,5-dimethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide;3-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-5-carboxamide;5-[3-(dimethylamino)propanoylamino]-1-methyl-N-[1-methyl-3-(propylcarbamoyl)pyrazol-5-yl]pyrazole-3-carboxamide;3-[[5-[3-(dimethylamino)propanoylamino]-1-methylpyrazole-3-carbonyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide is sourced from PubChem (CID 157099716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).