1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide

C157H189N35O19 — CID 167594817

IUPAC1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide
SMILESCOc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C(N)CC(O)c3ccccc3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C(N)CCC(=O)N3CCCC3C#N)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C(N)CCC(=O)N3CCCC3C(C)C)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C3CC(c4cnccn4)CN3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C3NCCc4cc(OC)ccc43)C2)cc1
InChIInChI=1S/C33H45N7O4.C32H36N6O4.C31H38N8O4.C31H36N6O4.C30H34N8O3/c1-21(2)28-6-5-15-39(28)31(41)14-12-26(34)33(43)40-20-24(16-22-7-10-25(44-4)11-8-22)18-30(40)32(42)35-19-23-9-13-29-27(17-23)36-37-38(29)3;1-37-28-11-6-21(15-27(28)35-36-37)18-34-31(39)29-16-22(14-20-4-7-24(41-2)8-5-20)19-38(29)32(40)30-26-10-9-25(42-3)17-23(26)12-13-33-30;1-37-27-11-7-21(15-26(27)35-36-37)18-34-30(41)28-16-22(14-20-5-8-24(43-2)9-6-20)19-39(28)31(42)25(33)10-12-29(40)38-13-3-4-23(38)17-32;1-36-27-13-10-21(15-26(27)34-35-36)18-33-30(39)28-16-22(14-20-8-11-24(41-2)12-9-20)19-37(28)31(40)25(32)17-29(38)23-6-4-3-5-7-23;1-37-27-8-5-20(12-24(27)35-36-37)15-34-29(39)28-13-21(11-19-3-6-23(41-2)7-4-19)18-38(28)30(40)25-14-22(16-33-25)26-17-31-9-10-32-26/h7-11,13,17,21,24,26,28,30H,5-6,12,14-16,18-20,34H2,1-4H3,(H,35,42);4-11,15,17,22,29-30,33H,12-14,16,18-19H2,1-3H3,(H,34,39);5-9,11,15,22-23,25,28H,3-4,10,12-14,16,18-19,33H2,1-2H3,(H,34,41);3-13,15,22,25,28-29,38H,14,16-19,32H2,1-2H3,(H,33,39);3-10,12,17,21-22,25,28,33H,11,13-16,18H2,1-2H3,(H,34,39)
InChIKeyIXLVJDANGIVMDX-UHFFFAOYSA-N
MW2870.46 g/mol
LogP11.92
Rot. Bonds47

About 1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide

1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide (PubChem CID 167594817) has the molecular formula C157H189N35O19 and a molecular weight of 2870.46 g/mol. Its IUPAC name is 1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide
PubChem CID167594817
Molecular FormulaC157H189N35O19
Molecular Weight2870.46 g/mol
Exact Mass2868.49
IUPAC Name1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide
SMILESCOc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C(N)CC(O)c3ccccc3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C(N)CCC(=O)N3CCCC3C#N)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C(N)CCC(=O)N3CCCC3C(C)C)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C3CC(c4cnccn4)CN3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C3NCCc4cc(OC)ccc43)C2)cc1
InChIInChI=1S/C33H45N7O4.C32H36N6O4.C31H38N8O4.C31H36N6O4.C30H34N8O3/c1-21(2)28-6-5-15-39(28)31(41)14-12-26(34)33(43)40-20-24(16-22-7-10-25(44-4)11-8-22)18-30(40)32(42)35-19-23-9-13-29-27(17-23)36-37-38(29)3;1-37-28-11-6-21(15-27(28)35-36-37)18-34-31(39)29-16-22(14-20-4-7-24(41-2)8-5-20)19-38(29)32(40)30-26-10-9-25(42-3)17-23(26)12-13-33-30;1-37-27-11-7-21(15-26(27)35-36-37)18-34-30(41)28-16-22(14-20-5-8-24(43-2)9-6-20)19-39(28)31(42)25(33)10-12-29(40)38-13-3-4-23(38)17-32;1-36-27-13-10-21(15-26(27)34-35-36)18-33-30(39)28-16-22(14-20-8-11-24(41-2)12-9-20)19-37(28)31(40)25(32)17-29(38)23-6-4-3-5-7-23;1-37-27-8-5-20(12-24(27)35-36-37)15-34-29(39)28-13-21(11-19-3-6-23(41-2)7-4-19)18-38(28)30(40)25-14-22(16-33-25)26-17-31-9-10-32-26/h7-11,13,17,21,24,26,28,30H,5-6,12,14-16,18-20,34H2,1-4H3,(H,35,42);4-11,15,17,22,29-30,33H,12-14,16,18-19H2,1-3H3,(H,34,39);5-9,11,15,22-23,25,28H,3-4,10,12-14,16,18-19,33H2,1-2H3,(H,34,41);3-13,15,22,25,28-29,38H,14,16-19,32H2,1-2H3,(H,33,39);3-10,12,17,21-22,25,28,33H,11,13-16,18H2,1-2H3,(H,34,39)
InChIKeyIXLVJDANGIVMDX-UHFFFAOYSA-N
XLogP11.92
TPSA668.52 Ų
H-Bond Donors11
H-Bond Acceptors42
Rotatable Bonds47
Heavy Atoms211
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002870.46
LogP ≤ 511.92
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1042

Analyze 1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide (CID 167594817) is 1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide is COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C(N)CC(O)c3ccccc3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C(N)CCC(=O)N3CCCC3C#N)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C(N)CCC(=O)N3CCCC3C(C)C)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C3CC(c4cnccn4)CN3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C3NCCc4cc(OC)ccc43)C2)cc1.
What is the InChIKey of 1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide?
The InChIKey is IXLVJDANGIVMDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H45N7O4.C32H36N6O4.C31H38N8O4.C31H36N6O4.C30H34N8O3/c1-21(2)28-6-5-15-39(28)31(41)14-12-26(34)33(43)40-20-24(16-22-7-10-25(44-4)11-8-22)18-30(40)32(42)35-19-23-9-13-29-27(17-23)36-37-38(29)3;1-37-28-11-6-21(15-27(28)35-36-37)18-34-31(39)29-16-22(14-20-4-7-24(41-2)8-5-20)19-38(29)32(40)30-26-10-9-25(42-3)17-23(26)12-13-33-30;1-37-27-11-7-21(15-26(27)35-36-37)18-34-30(41)28-16-22(14-20-5-8-24(43-2)9-6-20)19-39(28)31(42)25(33)10-12-29(40)38-13-3-4-23(38)17-32;1-36-27-13-10-21(15-26(27)34-35-36)18-33-30(39)28-16-22(14-20-8-11-24(41-2)12-9-20)19-37(28)31(40)25(32)17-29(38)23-6-4-3-5-7-23;1-37-27-8-5-20(12-24(27)35-36-37)15-34-29(39)28-13-21(11-19-3-6-23(41-2)7-4-19)18-38(28)30(40)25-14-22(16-33-25)26-17-31-9-10-32-26/h7-11,13,17,21,24,26,28,30H,5-6,12,14-16,18-20,34H2,1-4H3,(H,35,42);4-11,15,17,22,29-30,33H,12-14,16,18-19H2,1-3H3,(H,34,39);5-9,11,15,22-23,25,28H,3-4,10,12-14,16,18-19,33H2,1-2H3,(H,34,41);3-13,15,22,25,28-29,38H,14,16-19,32H2,1-2H3,(H,33,39);3-10,12,17,21-22,25,28,33H,11,13-16,18H2,1-2H3,(H,34,39).
What are the key properties of 1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide?
1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide has a molecular weight of 2870.46 g/mol, XLogP of 11.92, 47 rotatable bonds, 11 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-amino-5-(2-cyanopyrrolidin-1-yl)-5-oxopentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-4-hydroxy-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-[2-amino-5-oxo-5-(2-propan-2-ylpyrrolidin-1-yl)pentanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-pyrazin-2-ylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 167594817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).