5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide

C141H182N38O18 — CID 163624177

IUPAC5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
SMILESCC(C(=O)Nc1cc(C(C)(C)C)no1)c1ccc(-c2nn(C(C)C)c(N)c2C(N)=O)cc1.CC(C(=O)Nc1cc(C(C)(C)C)on1)c1ccc(-c2nn(C3(C)CC3)c(N)c2C(N)=O)nc1.CC(C(=O)Nc1cc(C2(C)CC2)no1)c1ccc(-c2nn(C(C)C)c(N)c2C(N)=O)cc1.CC(C(=O)Nc1cc(CC(C)(C)C)no1)c1ccc(-c2nn(C(C)C)c(N)c2C(N)=O)cc1.CC(C(=O)Nc1cc(CC(C)(C)C)no1)c1ccc(-c2nn(C3(C)CC3)c(N)c2C(N)=O)nc1.CCC(C)(C)c1cc(NC(=O)C(C)c2ccc(-c3nn(C(C)C)c(N)c3C(N)=O)cc2)on1
InChIInChI=1S/C24H31N7O3.2C24H32N6O3.C23H29N7O3.C23H28N6O3.C23H30N6O3/c1-13(22(33)28-17-10-15(30-34-17)11-23(2,3)4)14-6-7-16(27-12-14)19-18(21(26)32)20(25)31(29-19)24(5)8-9-24;1-13(2)30-21(25)19(22(26)31)20(28-30)16-9-7-15(8-10-16)14(3)23(32)27-18-11-17(29-33-18)12-24(4,5)6;1-7-24(5,6)17-12-18(33-29-17)27-23(32)14(4)15-8-10-16(11-9-15)20-19(22(26)31)21(25)30(28-20)13(2)3;1-12(21(32)27-16-10-15(33-29-16)22(2,3)4)13-6-7-14(26-11-13)18-17(20(25)31)19(24)30(28-18)23(5)8-9-23;1-12(2)29-20(24)18(21(25)30)19(27-29)15-7-5-14(6-8-15)13(3)22(31)26-17-11-16(28-32-17)23(4)9-10-23;1-12(2)29-20(24)18(21(25)30)19(27-29)15-9-7-14(8-10-15)13(3)22(31)26-17-11-16(28-32-17)23(4,5)6/h6-7,10,12-13H,8-9,11,25H2,1-5H3,(H2,26,32)(H,28,33);7-11,13-14H,12,25H2,1-6H3,(H2,26,31)(H,27,32);8-14H,7,25H2,1-6H3,(H2,26,31)(H,27,32);6-7,10-12H,8-9,24H2,1-5H3,(H2,25,31)(H,27,29,32);5-8,11-13H,9-10,24H2,1-4H3,(H2,25,30)(H,26,31);7-13H,24H2,1-6H3,(H2,25,30)(H,26,31)
InChIKeyHQQZAACAUMMNKT-UHFFFAOYSA-N
MW2697.25 g/mol
LogP22.41
Rot. Bonds41

About 5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide

5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide (PubChem CID 163624177) has the molecular formula C141H182N38O18 and a molecular weight of 2697.25 g/mol. Its IUPAC name is 5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
PubChem CID163624177
Molecular FormulaC141H182N38O18
Molecular Weight2697.25 g/mol
Exact Mass2695.45
IUPAC Name5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide
SMILESCC(C(=O)Nc1cc(C(C)(C)C)no1)c1ccc(-c2nn(C(C)C)c(N)c2C(N)=O)cc1.CC(C(=O)Nc1cc(C(C)(C)C)on1)c1ccc(-c2nn(C3(C)CC3)c(N)c2C(N)=O)nc1.CC(C(=O)Nc1cc(C2(C)CC2)no1)c1ccc(-c2nn(C(C)C)c(N)c2C(N)=O)cc1.CC(C(=O)Nc1cc(CC(C)(C)C)no1)c1ccc(-c2nn(C(C)C)c(N)c2C(N)=O)cc1.CC(C(=O)Nc1cc(CC(C)(C)C)no1)c1ccc(-c2nn(C3(C)CC3)c(N)c2C(N)=O)nc1.CCC(C)(C)c1cc(NC(=O)C(C)c2ccc(-c3nn(C(C)C)c(N)c3C(N)=O)cc2)on1
InChIInChI=1S/C24H31N7O3.2C24H32N6O3.C23H29N7O3.C23H28N6O3.C23H30N6O3/c1-13(22(33)28-17-10-15(30-34-17)11-23(2,3)4)14-6-7-16(27-12-14)19-18(21(26)32)20(25)31(29-19)24(5)8-9-24;1-13(2)30-21(25)19(22(26)31)20(28-30)16-9-7-15(8-10-16)14(3)23(32)27-18-11-17(29-33-18)12-24(4,5)6;1-7-24(5,6)17-12-18(33-29-17)27-23(32)14(4)15-8-10-16(11-9-15)20-19(22(26)31)21(25)30(28-20)13(2)3;1-12(21(32)27-16-10-15(33-29-16)22(2,3)4)13-6-7-14(26-11-13)18-17(20(25)31)19(24)30(28-18)23(5)8-9-23;1-12(2)29-20(24)18(21(25)30)19(27-29)15-7-5-14(6-8-15)13(3)22(31)26-17-11-16(28-32-17)23(4)9-10-23;1-12(2)29-20(24)18(21(25)30)19(27-29)15-9-7-14(8-10-15)13(3)22(31)26-17-11-16(28-32-17)23(4,5)6/h6-7,10,12-13H,8-9,11,25H2,1-5H3,(H2,26,32)(H,28,33);7-11,13-14H,12,25H2,1-6H3,(H2,26,31)(H,27,32);8-14H,7,25H2,1-6H3,(H2,26,31)(H,27,32);6-7,10-12H,8-9,24H2,1-5H3,(H2,25,31)(H,27,29,32);5-8,11-13H,9-10,24H2,1-4H3,(H2,25,30)(H,26,31);7-13H,24H2,1-6H3,(H2,25,30)(H,26,31)
InChIKeyHQQZAACAUMMNKT-UHFFFAOYSA-N
XLogP22.41
TPSA878.14 Ų
H-Bond Donors18
H-Bond Acceptors44
Rotatable Bonds41
Heavy Atoms197
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002697.25
LogP ≤ 522.41
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1044

Analyze 5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide?
The IUPAC name of 5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide (CID 163624177) is 5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide?
The canonical SMILES for 5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide is CC(C(=O)Nc1cc(C(C)(C)C)no1)c1ccc(-c2nn(C(C)C)c(N)c2C(N)=O)cc1.CC(C(=O)Nc1cc(C(C)(C)C)on1)c1ccc(-c2nn(C3(C)CC3)c(N)c2C(N)=O)nc1.CC(C(=O)Nc1cc(C2(C)CC2)no1)c1ccc(-c2nn(C(C)C)c(N)c2C(N)=O)cc1.CC(C(=O)Nc1cc(CC(C)(C)C)no1)c1ccc(-c2nn(C(C)C)c(N)c2C(N)=O)cc1.CC(C(=O)Nc1cc(CC(C)(C)C)no1)c1ccc(-c2nn(C3(C)CC3)c(N)c2C(N)=O)nc1.CCC(C)(C)c1cc(NC(=O)C(C)c2ccc(-c3nn(C(C)C)c(N)c3C(N)=O)cc2)on1.
What is the InChIKey of 5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide?
The InChIKey is HQQZAACAUMMNKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N7O3.2C24H32N6O3.C23H29N7O3.C23H28N6O3.C23H30N6O3/c1-13(22(33)28-17-10-15(30-34-17)11-23(2,3)4)14-6-7-16(27-12-14)19-18(21(26)32)20(25)31(29-19)24(5)8-9-24;1-13(2)30-21(25)19(22(26)31)20(28-30)16-9-7-15(8-10-16)14(3)23(32)27-18-11-17(29-33-18)12-24(4,5)6;1-7-24(5,6)17-12-18(33-29-17)27-23(32)14(4)15-8-10-16(11-9-15)20-19(22(26)31)21(25)30(28-20)13(2)3;1-12(21(32)27-16-10-15(33-29-16)22(2,3)4)13-6-7-14(26-11-13)18-17(20(25)31)19(24)30(28-18)23(5)8-9-23;1-12(2)29-20(24)18(21(25)30)19(27-29)15-7-5-14(6-8-15)13(3)22(31)26-17-11-16(28-32-17)23(4)9-10-23;1-12(2)29-20(24)18(21(25)30)19(27-29)15-9-7-14(8-10-15)13(3)22(31)26-17-11-16(28-32-17)23(4,5)6/h6-7,10,12-13H,8-9,11,25H2,1-5H3,(H2,26,32)(H,28,33);7-11,13-14H,12,25H2,1-6H3,(H2,26,31)(H,27,32);8-14H,7,25H2,1-6H3,(H2,26,31)(H,27,32);6-7,10-12H,8-9,24H2,1-5H3,(H2,25,31)(H,27,29,32);5-8,11-13H,9-10,24H2,1-4H3,(H2,25,30)(H,26,31);7-13H,24H2,1-6H3,(H2,25,30)(H,26,31).
What are the key properties of 5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide?
5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide has a molecular weight of 2697.25 g/mol, XLogP of 22.41, 41 rotatable bonds, 18 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-[4-[1-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[5-[1-[[3-(2,2-dimethylpropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]-2-pyridinyl]-1-(1-methylcyclopropyl)pyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(2-methylbutan-2-yl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide;5-amino-3-[4-[1-[[3-(1-methylcyclopropyl)-1,2-oxazol-5-yl]amino]-1-oxopropan-2-yl]phenyl]-1-propan-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 163624177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).