N-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide

C251H256ClN61O33S2 — CID 157139324

IUPACN-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide
SMILESCc1cc(CC(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)ccc1O.Cc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)cc1O.Cc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)o1.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1c[nH]ccc1=O)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cc(Cl)ccn1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1ccccc1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cccnc1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cocn1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cscn1.O=C(NCCCNC(=O)c1ccccc1O)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1ncco1)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1nccs1)c1cc(-c2ccccc2)n[nH]1
InChIInChI=1S/C24H26N6O2.C22H24N4O3.C21H22N4O3.C20H20N4O3.C20H20N4O2.C19H18ClN5O2.C19H19N5O3.C19H19N5O2.C19H20N4O3.2C17H17N5O3.2C17H17N5O2S/c25-19(13-17-15-28-20-10-5-4-9-18(17)20)23(31)26-11-6-12-27-24(32)22-14-21(29-30-22)16-7-2-1-3-8-16;1-15-12-16(8-9-20(15)27)13-21(28)23-10-5-11-24-22(29)19-14-18(25-26-19)17-6-3-2-4-7-17;1-14-8-9-16(12-19(14)26)20(27)22-10-5-11-23-21(28)18-13-17(24-25-18)15-6-3-2-4-7-15;25-18-10-5-4-9-15(18)19(26)21-11-6-12-22-20(27)17-13-16(23-24-17)14-7-2-1-3-8-14;25-19(16-10-5-2-6-11-16)21-12-7-13-22-20(26)18-14-17(23-24-18)15-8-3-1-4-9-15;20-14-7-10-21-16(11-14)18(26)22-8-4-9-23-19(27)17-12-15(24-25-17)13-5-2-1-3-6-13;25-17-7-10-20-12-14(17)18(26)21-8-4-9-22-19(27)16-11-15(23-24-16)13-5-2-1-3-6-13;25-18(15-8-4-9-20-13-15)21-10-5-11-22-19(26)17-12-16(23-24-17)14-6-2-1-3-7-14;1-13-8-9-17(26-13)19(25)21-11-5-10-20-18(24)16-12-15(22-23-16)14-6-3-2-4-7-14;23-16(14-9-13(21-22-14)12-5-2-1-3-6-12)18-7-4-8-19-17(24)15-10-25-11-20-15;23-15(14-11-13(21-22-14)12-5-2-1-3-6-12)18-7-4-8-19-16(24)17-20-9-10-25-17;23-16(14-9-13(21-22-14)12-5-2-1-3-6-12)18-7-4-8-19-17(24)15-10-25-11-20-15;23-15(14-11-13(21-22-14)12-5-2-1-3-6-12)18-7-4-8-19-16(24)17-20-9-10-25-17/h1-5,7-10,14-15,19,28H,6,11-13,25H2,(H,26,31)(H,27,32)(H,29,30);2-4,6-9,12,14,27H,5,10-11,13H2,1H3,(H,23,28)(H,24,29)(H,25,26);2-4,6-9,12-13,26H,5,10-11H2,1H3,(H,22,27)(H,23,28)(H,24,25);1-5,7-10,13,25H,6,11-12H2,(H,21,26)(H,22,27)(H,23,24);1-6,8-11,14H,7,12-13H2,(H,21,25)(H,22,26)(H,23,24);1-3,5-7,10-12H,4,8-9H2,(H,22,26)(H,23,27)(H,24,25);1-3,5-7,10-12H,4,8-9H2,(H,20,25)(H,21,26)(H,22,27)(H,23,24);1-4,6-9,12-13H,5,10-11H2,(H,21,25)(H,22,26)(H,23,24);2-4,6-9,12H,5,10-11H2,1H3,(H,20,24)(H,21,25)(H,22,23);4*1-3,5-6,9-11H,4,7-8H2,(H,18,23)(H,19,24)(H,21,22)/t19-;;;;;;;;;;;;/m0............/s1
InChIKeyAJZUETITOWDCQS-SARYEQCUSA-N
MW4754.79 g/mol
LogP28.47
Rot. Bonds94

About N-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide

N-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide (PubChem CID 157139324) has the molecular formula C251H256ClN61O33S2 and a molecular weight of 4754.79 g/mol. Its IUPAC name is N-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide
PubChem CID157139324
Molecular FormulaC251H256ClN61O33S2
Molecular Weight4754.79 g/mol
Exact Mass4750.94
IUPAC NameN-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide
SMILESCc1cc(CC(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)ccc1O.Cc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)cc1O.Cc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)o1.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1c[nH]ccc1=O)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cc(Cl)ccn1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1ccccc1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cccnc1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cocn1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cscn1.O=C(NCCCNC(=O)c1ccccc1O)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1ncco1)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1nccs1)c1cc(-c2ccccc2)n[nH]1
InChIInChI=1S/C24H26N6O2.C22H24N4O3.C21H22N4O3.C20H20N4O3.C20H20N4O2.C19H18ClN5O2.C19H19N5O3.C19H19N5O2.C19H20N4O3.2C17H17N5O3.2C17H17N5O2S/c25-19(13-17-15-28-20-10-5-4-9-18(17)20)23(31)26-11-6-12-27-24(32)22-14-21(29-30-22)16-7-2-1-3-8-16;1-15-12-16(8-9-20(15)27)13-21(28)23-10-5-11-24-22(29)19-14-18(25-26-19)17-6-3-2-4-7-17;1-14-8-9-16(12-19(14)26)20(27)22-10-5-11-23-21(28)18-13-17(24-25-18)15-6-3-2-4-7-15;25-18-10-5-4-9-15(18)19(26)21-11-6-12-22-20(27)17-13-16(23-24-17)14-7-2-1-3-8-14;25-19(16-10-5-2-6-11-16)21-12-7-13-22-20(26)18-14-17(23-24-18)15-8-3-1-4-9-15;20-14-7-10-21-16(11-14)18(26)22-8-4-9-23-19(27)17-12-15(24-25-17)13-5-2-1-3-6-13;25-17-7-10-20-12-14(17)18(26)21-8-4-9-22-19(27)16-11-15(23-24-16)13-5-2-1-3-6-13;25-18(15-8-4-9-20-13-15)21-10-5-11-22-19(26)17-12-16(23-24-17)14-6-2-1-3-7-14;1-13-8-9-17(26-13)19(25)21-11-5-10-20-18(24)16-12-15(22-23-16)14-6-3-2-4-7-14;23-16(14-9-13(21-22-14)12-5-2-1-3-6-12)18-7-4-8-19-17(24)15-10-25-11-20-15;23-15(14-11-13(21-22-14)12-5-2-1-3-6-12)18-7-4-8-19-16(24)17-20-9-10-25-17;23-16(14-9-13(21-22-14)12-5-2-1-3-6-12)18-7-4-8-19-17(24)15-10-25-11-20-15;23-15(14-11-13(21-22-14)12-5-2-1-3-6-12)18-7-4-8-19-16(24)17-20-9-10-25-17/h1-5,7-10,14-15,19,28H,6,11-13,25H2,(H,26,31)(H,27,32)(H,29,30);2-4,6-9,12,14,27H,5,10-11,13H2,1H3,(H,23,28)(H,24,29)(H,25,26);2-4,6-9,12-13,26H,5,10-11H2,1H3,(H,22,27)(H,23,28)(H,24,25);1-5,7-10,13,25H,6,11-12H2,(H,21,26)(H,22,27)(H,23,24);1-6,8-11,14H,7,12-13H2,(H,21,25)(H,22,26)(H,23,24);1-3,5-7,10-12H,4,8-9H2,(H,22,26)(H,23,27)(H,24,25);1-3,5-7,10-12H,4,8-9H2,(H,20,25)(H,21,26)(H,22,27)(H,23,24);1-4,6-9,12-13H,5,10-11H2,(H,21,25)(H,22,26)(H,23,24);2-4,6-9,12H,5,10-11H2,1H3,(H,20,24)(H,21,25)(H,22,23);4*1-3,5-6,9-11H,4,7-8H2,(H,18,23)(H,19,24)(H,21,22)/t19-;;;;;;;;;;;;/m0............/s1
InChIKeyAJZUETITOWDCQS-SARYEQCUSA-N
XLogP28.47
TPSA1381.56 Ų
H-Bond Donors45
H-Bond Acceptors55
Rotatable Bonds94
Heavy Atoms348
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004754.79
LogP ≤ 528.47
H-Bond Donors ≤ 545
H-Bond Acceptors ≤ 1055

Analyze N-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide?
The IUPAC name of N-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide (CID 157139324) is N-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide is Cc1cc(CC(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)ccc1O.Cc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)cc1O.Cc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)o1.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1c[nH]ccc1=O)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cc(Cl)ccn1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1ccccc1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cccnc1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cocn1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cscn1.O=C(NCCCNC(=O)c1ccccc1O)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1ncco1)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1nccs1)c1cc(-c2ccccc2)n[nH]1.
What is the InChIKey of N-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide?
The InChIKey is AJZUETITOWDCQS-SARYEQCUSA-N. The full InChI is InChI=1S/C24H26N6O2.C22H24N4O3.C21H22N4O3.C20H20N4O3.C20H20N4O2.C19H18ClN5O2.C19H19N5O3.C19H19N5O2.C19H20N4O3.2C17H17N5O3.2C17H17N5O2S/c25-19(13-17-15-28-20-10-5-4-9-18(17)20)23(31)26-11-6-12-27-24(32)22-14-21(29-30-22)16-7-2-1-3-8-16;1-15-12-16(8-9-20(15)27)13-21(28)23-10-5-11-24-22(29)19-14-18(25-26-19)17-6-3-2-4-7-17;1-14-8-9-16(12-19(14)26)20(27)22-10-5-11-23-21(28)18-13-17(24-25-18)15-6-3-2-4-7-15;25-18-10-5-4-9-15(18)19(26)21-11-6-12-22-20(27)17-13-16(23-24-17)14-7-2-1-3-8-14;25-19(16-10-5-2-6-11-16)21-12-7-13-22-20(26)18-14-17(23-24-18)15-8-3-1-4-9-15;20-14-7-10-21-16(11-14)18(26)22-8-4-9-23-19(27)17-12-15(24-25-17)13-5-2-1-3-6-13;25-17-7-10-20-12-14(17)18(26)21-8-4-9-22-19(27)16-11-15(23-24-16)13-5-2-1-3-6-13;25-18(15-8-4-9-20-13-15)21-10-5-11-22-19(26)17-12-16(23-24-17)14-6-2-1-3-7-14;1-13-8-9-17(26-13)19(25)21-11-5-10-20-18(24)16-12-15(22-23-16)14-6-3-2-4-7-14;23-16(14-9-13(21-22-14)12-5-2-1-3-6-12)18-7-4-8-19-17(24)15-10-25-11-20-15;23-15(14-11-13(21-22-14)12-5-2-1-3-6-12)18-7-4-8-19-16(24)17-20-9-10-25-17;23-16(14-9-13(21-22-14)12-5-2-1-3-6-12)18-7-4-8-19-17(24)15-10-25-11-20-15;23-15(14-11-13(21-22-14)12-5-2-1-3-6-12)18-7-4-8-19-16(24)17-20-9-10-25-17/h1-5,7-10,14-15,19,28H,6,11-13,25H2,(H,26,31)(H,27,32)(H,29,30);2-4,6-9,12,14,27H,5,10-11,13H2,1H3,(H,23,28)(H,24,29)(H,25,26);2-4,6-9,12-13,26H,5,10-11H2,1H3,(H,22,27)(H,23,28)(H,24,25);1-5,7-10,13,25H,6,11-12H2,(H,21,26)(H,22,27)(H,23,24);1-6,8-11,14H,7,12-13H2,(H,21,25)(H,22,26)(H,23,24);1-3,5-7,10-12H,4,8-9H2,(H,22,26)(H,23,27)(H,24,25);1-3,5-7,10-12H,4,8-9H2,(H,20,25)(H,21,26)(H,22,27)(H,23,24);1-4,6-9,12-13H,5,10-11H2,(H,21,25)(H,22,26)(H,23,24);2-4,6-9,12H,5,10-11H2,1H3,(H,20,24)(H,21,25)(H,22,23);4*1-3,5-6,9-11H,4,7-8H2,(H,18,23)(H,19,24)(H,21,22)/t19-;;;;;;;;;;;;/m0............/s1.
What are the key properties of N-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide?
N-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide has a molecular weight of 4754.79 g/mol, XLogP of 28.47, 94 rotatable bonds, 45 hydrogen bond donors, and 55 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-(3-benzamidopropyl)-3-phenyl-1H-pyrazole-5-carboxamide;4-chloro-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-[(2-hydroxybenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(3-hydroxy-4-methylbenzoyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[[2-(4-hydroxy-3-methylphenyl)acetyl]amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-oxo-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1H-pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-oxazole-4-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-2-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 157139324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).