1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen

C156H189FN28O16 — CID 167607031

IUPAC1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen
SMILESCOc1ccc(CC2CC(C(=O)NCc3cc4ccncc4[nH]3)N(C(=O)C(N)CCC(=O)N3CCCC3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3cc4ccncc4[nH]3)N(C(=O)C(N)CCc3ccccc3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3cc4ccncc4[nH]3)N(C(=O)C3CC(c4ccccc4)CN3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C(N)CCc3ccc(F)cc3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C3CC(c4ccccc4)CN3)C2)cc1.[H][H].[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C32H36N6O3.C32H35N5O3.C31H35FN6O3.C31H35N5O3.C30H38N6O4.5H2/c1-37-29-13-10-22(15-27(29)35-36-37)18-34-31(39)30-16-23(14-21-8-11-26(41-2)12-9-21)20-38(30)32(40)28-17-25(19-33-28)24-6-4-3-5-7-24;1-40-27-9-7-21(8-10-27)13-22-14-30(31(38)35-18-26-15-24-11-12-33-19-29(24)36-26)37(20-22)32(39)28-16-25(17-34-28)23-5-3-2-4-6-23;1-37-28-14-8-22(16-27(28)35-36-37)18-34-30(39)29-17-23(15-21-5-11-25(41-2)12-6-21)19-38(29)31(40)26(33)13-7-20-3-9-24(32)10-4-20;1-39-26-10-7-22(8-11-26)15-23-16-29(30(37)34-18-25-17-24-13-14-33-19-28(24)35-25)36(20-23)31(38)27(32)12-9-21-5-3-2-4-6-21;1-40-24-6-4-20(5-7-24)14-21-15-27(29(38)33-17-23-16-22-10-11-32-18-26(22)34-23)36(19-21)30(39)25(31)8-9-28(37)35-12-2-3-13-35;;;;;/h3-13,15,23,25,28,30,33H,14,16-20H2,1-2H3,(H,34,39);2-12,15,19,22,25,28,30,34,36H,13-14,16-18,20H2,1H3,(H,35,38);3-6,8-12,14,16,23,26,29H,7,13,15,17-19,33H2,1-2H3,(H,34,39);2-8,10-11,13-14,17,19,23,27,29,35H,9,12,15-16,18,20,32H2,1H3,(H,34,37);4-7,10-11,16,18,21,25,27,34H,2-3,8-9,12-15,17,19,31H2,1H3,(H,33,38);5*1H
InChIKeyKNDOMYFCLFGNRO-UHFFFAOYSA-N
MW2731.41 g/mol
LogP17.36
Rot. Bonds46

About 1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen

1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen (PubChem CID 167607031) has the molecular formula C156H189FN28O16 and a molecular weight of 2731.41 g/mol. Its IUPAC name is 1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen.

Molecular Properties

Compound Name1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen
PubChem CID167607031
Molecular FormulaC156H189FN28O16
Molecular Weight2731.41 g/mol
Exact Mass2729.48
IUPAC Name1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen
SMILESCOc1ccc(CC2CC(C(=O)NCc3cc4ccncc4[nH]3)N(C(=O)C(N)CCC(=O)N3CCCC3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3cc4ccncc4[nH]3)N(C(=O)C(N)CCc3ccccc3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3cc4ccncc4[nH]3)N(C(=O)C3CC(c4ccccc4)CN3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C(N)CCc3ccc(F)cc3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C3CC(c4ccccc4)CN3)C2)cc1.[H][H].[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C32H36N6O3.C32H35N5O3.C31H35FN6O3.C31H35N5O3.C30H38N6O4.5H2/c1-37-29-13-10-22(15-27(29)35-36-37)18-34-31(39)30-16-23(14-21-8-11-26(41-2)12-9-21)20-38(30)32(40)28-17-25(19-33-28)24-6-4-3-5-7-24;1-40-27-9-7-21(8-10-27)13-22-14-30(31(38)35-18-26-15-24-11-12-33-19-29(24)36-26)37(20-22)32(39)28-16-25(17-34-28)23-5-3-2-4-6-23;1-37-28-14-8-22(16-27(28)35-36-37)18-34-30(39)29-17-23(15-21-5-11-25(41-2)12-6-21)19-38(29)31(40)26(33)13-7-20-3-9-24(32)10-4-20;1-39-26-10-7-22(8-11-26)15-23-16-29(30(37)34-18-25-17-24-13-14-33-19-28(24)35-25)36(20-23)31(38)27(32)12-9-21-5-3-2-4-6-21;1-40-24-6-4-20(5-7-24)14-21-15-27(29(38)33-17-23-16-22-10-11-32-18-26(22)34-23)36(19-21)30(39)25(31)8-9-28(37)35-12-2-3-13-35;;;;;/h3-13,15,23,25,28,30,33H,14,16-20H2,1-2H3,(H,34,39);2-12,15,19,22,25,28,30,34,36H,13-14,16-18,20H2,1H3,(H,35,38);3-6,8-12,14,16,23,26,29H,7,13,15,17-19,33H2,1-2H3,(H,34,39);2-8,10-11,13-14,17,19,23,27,29,35H,9,12,15-16,18,20,32H2,1H3,(H,34,37);4-7,10-11,16,18,21,25,27,34H,2-3,8-9,12-15,17,19,31H2,1H3,(H,33,38);5*1H
InChIKeyKNDOMYFCLFGNRO-UHFFFAOYSA-N
XLogP17.36
TPSA563.09 Ų
H-Bond Donors13
H-Bond Acceptors30
Rotatable Bonds46
Heavy Atoms201
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002731.41
LogP ≤ 517.36
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1030

Analyze 1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen?
The IUPAC name of 1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen (CID 167607031) is 1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen.
What is the SMILES notation for 1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen?
The canonical SMILES for 1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen is COc1ccc(CC2CC(C(=O)NCc3cc4ccncc4[nH]3)N(C(=O)C(N)CCC(=O)N3CCCC3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3cc4ccncc4[nH]3)N(C(=O)C(N)CCc3ccccc3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3cc4ccncc4[nH]3)N(C(=O)C3CC(c4ccccc4)CN3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C(N)CCc3ccc(F)cc3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C3CC(c4ccccc4)CN3)C2)cc1.[H][H].[H][H].[H][H].[H][H].[H][H].
What is the InChIKey of 1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen?
The InChIKey is KNDOMYFCLFGNRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H36N6O3.C32H35N5O3.C31H35FN6O3.C31H35N5O3.C30H38N6O4.5H2/c1-37-29-13-10-22(15-27(29)35-36-37)18-34-31(39)30-16-23(14-21-8-11-26(41-2)12-9-21)20-38(30)32(40)28-17-25(19-33-28)24-6-4-3-5-7-24;1-40-27-9-7-21(8-10-27)13-22-14-30(31(38)35-18-26-15-24-11-12-33-19-29(24)36-26)37(20-22)32(39)28-16-25(17-34-28)23-5-3-2-4-6-23;1-37-28-14-8-22(16-27(28)35-36-37)18-34-30(39)29-17-23(15-21-5-11-25(41-2)12-6-21)19-38(29)31(40)26(33)13-7-20-3-9-24(32)10-4-20;1-39-26-10-7-22(8-11-26)15-23-16-29(30(37)34-18-25-17-24-13-14-33-19-28(24)35-25)36(20-23)31(38)27(32)12-9-21-5-3-2-4-6-21;1-40-24-6-4-20(5-7-24)14-21-15-27(29(38)33-17-23-16-22-10-11-32-18-26(22)34-23)36(19-21)30(39)25(31)8-9-28(37)35-12-2-3-13-35;;;;;/h3-13,15,23,25,28,30,33H,14,16-20H2,1-2H3,(H,34,39);2-12,15,19,22,25,28,30,34,36H,13-14,16-18,20H2,1H3,(H,35,38);3-6,8-12,14,16,23,26,29H,7,13,15,17-19,33H2,1-2H3,(H,34,39);2-8,10-11,13-14,17,19,23,27,29,35H,9,12,15-16,18,20,32H2,1H3,(H,34,37);4-7,10-11,16,18,21,25,27,34H,2-3,8-9,12-15,17,19,31H2,1H3,(H,33,38);5*1H.
What are the key properties of 1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen?
1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen has a molecular weight of 2731.41 g/mol, XLogP of 17.36, 46 rotatable bonds, 13 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-amino-4-(4-fluorophenyl)butanoyl]-4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;1-(2-amino-4-phenylbutanoyl)-4-[(4-methoxyphenyl)methyl]-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-1-(4-phenylpyrrolidine-2-carbonyl)-N-(1H-pyrrolo[2,3-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;molecular hydrogen is sourced from PubChem (CID 167607031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).