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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide

C156H192N32O19S — CID 167652187

IUPAC1-[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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
SMILESCOc1ccc(CC2CC(C(=O)NCc3cc4cnccc4o3)N(C(=O)C(N)CCC(=O)N3CCCC3)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(c4cccnc4C)CN3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C3CC(c4cnccc4C)CN3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3nc4cnccc4s3)N(C(=O)C(N)CCC(=O)N3CCCC3)C2)cc1
InChIInChI=1S/C33H45N7O4.2C32H37N7O3.C30H37N5O5.C29H36N6O4S/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;1-20-10-11-33-18-26(20)24-15-28(34-17-24)32(41)39-19-23(12-21-4-7-25(42-3)8-5-21)14-30(39)31(40)35-16-22-6-9-29-27(13-22)36-37-38(29)2;1-20-26(5-4-12-33-20)24-16-28(34-18-24)32(41)39-19-23(13-21-6-9-25(42-3)10-7-21)15-30(39)31(40)35-17-22-8-11-29-27(14-22)36-37-38(29)2;1-39-23-6-4-20(5-7-23)14-21-15-26(29(37)33-18-24-16-22-17-32-11-10-27(22)40-24)35(19-21)30(38)25(31)8-9-28(36)34-12-2-3-13-34;1-39-21-6-4-19(5-7-21)14-20-15-24(28(37)32-17-26-33-23-16-31-11-10-25(23)40-26)35(18-20)29(38)22(30)8-9-27(36)34-12-2-3-13-34/h7-11,13,17,21,24,26,28,30H,5-6,12,14-16,18-20,34H2,1-4H3,(H,35,42);4-11,13,18,23-24,28,30,34H,12,14-17,19H2,1-3H3,(H,35,40);4-12,14,23-24,28,30,34H,13,15-19H2,1-3H3,(H,35,40);4-7,10-11,16-17,21,25-26H,2-3,8-9,12-15,18-19,31H2,1H3,(H,33,37);4-7,10-11,16,20,22,24H,2-3,8-9,12-15,17-18,30H2,1H3,(H,32,37)
InChIKeyQSWWQDOTQZMQFV-UHFFFAOYSA-N
MW2851.52 g/mol
LogP13.76
Rot. Bonds47

About 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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide (PubChem CID 167652187) has the molecular formula C156H192N32O19S and a molecular weight of 2851.52 g/mol. Its IUPAC name is 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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-[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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
PubChem CID167652187
Molecular FormulaC156H192N32O19S
Molecular Weight2851.52 g/mol
Exact Mass2849.48
IUPAC Name1-[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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
SMILESCOc1ccc(CC2CC(C(=O)NCc3cc4cnccc4o3)N(C(=O)C(N)CCC(=O)N3CCCC3)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(c4cccnc4C)CN3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C3CC(c4cnccc4C)CN3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3nc4cnccc4s3)N(C(=O)C(N)CCC(=O)N3CCCC3)C2)cc1
InChIInChI=1S/C33H45N7O4.2C32H37N7O3.C30H37N5O5.C29H36N6O4S/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;1-20-10-11-33-18-26(20)24-15-28(34-17-24)32(41)39-19-23(12-21-4-7-25(42-3)8-5-21)14-30(39)31(40)35-16-22-6-9-29-27(13-22)36-37-38(29)2;1-20-26(5-4-12-33-20)24-16-28(34-18-24)32(41)39-19-23(13-21-6-9-25(42-3)10-7-21)15-30(39)31(40)35-17-22-8-11-29-27(14-22)36-37-38(29)2;1-39-23-6-4-20(5-7-23)14-21-15-26(29(37)33-18-24-16-22-17-32-11-10-27(22)40-24)35(19-21)30(38)25(31)8-9-28(36)34-12-2-3-13-34;1-39-21-6-4-19(5-7-21)14-20-15-24(28(37)32-17-26-33-23-16-31-11-10-25(23)40-26)35(18-20)29(38)22(30)8-9-27(36)34-12-2-3-13-34/h7-11,13,17,21,24,26,28,30H,5-6,12,14-16,18-20,34H2,1-4H3,(H,35,42);4-11,13,18,23-24,28,30,34H,12,14-17,19H2,1-3H3,(H,35,40);4-12,14,23-24,28,30,34H,13,15-19H2,1-3H3,(H,35,40);4-7,10-11,16-17,21,25-26H,2-3,8-9,12-15,18-19,31H2,1H3,(H,33,37);4-7,10-11,16,20,22,24H,2-3,8-9,12-15,17-18,30H2,1H3,(H,32,37)
InChIKeyQSWWQDOTQZMQFV-UHFFFAOYSA-N
XLogP13.76
TPSA625.97 Ų
H-Bond Donors10
H-Bond Acceptors39
Rotatable Bonds47
Heavy Atoms208
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002851.52
LogP ≤ 513.76
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1039

Analyze 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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide?
The IUPAC name of 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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide (CID 167652187) is 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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide is COc1ccc(CC2CC(C(=O)NCc3cc4cnccc4o3)N(C(=O)C(N)CCC(=O)N3CCCC3)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(c4cccnc4C)CN3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3ccc4c(c3)nnn4C)N(C(=O)C3CC(c4cnccc4C)CN3)C2)cc1.COc1ccc(CC2CC(C(=O)NCc3nc4cnccc4s3)N(C(=O)C(N)CCC(=O)N3CCCC3)C2)cc1.
What is the InChIKey of 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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide?
The InChIKey is QSWWQDOTQZMQFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H45N7O4.2C32H37N7O3.C30H37N5O5.C29H36N6O4S/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;1-20-10-11-33-18-26(20)24-15-28(34-17-24)32(41)39-19-23(12-21-4-7-25(42-3)8-5-21)14-30(39)31(40)35-16-22-6-9-29-27(13-22)36-37-38(29)2;1-20-26(5-4-12-33-20)24-16-28(34-18-24)32(41)39-19-23(13-21-6-9-25(42-3)10-7-21)15-30(39)31(40)35-17-22-8-11-29-27(14-22)36-37-38(29)2;1-39-23-6-4-20(5-7-23)14-21-15-26(29(37)33-18-24-16-22-17-32-11-10-27(22)40-24)35(19-21)30(38)25(31)8-9-28(36)34-12-2-3-13-34;1-39-21-6-4-19(5-7-21)14-20-15-24(28(37)32-17-26-33-23-16-31-11-10-25(23)40-26)35(18-20)29(38)22(30)8-9-27(36)34-12-2-3-13-34/h7-11,13,17,21,24,26,28,30H,5-6,12,14-16,18-20,34H2,1-4H3,(H,35,42);4-11,13,18,23-24,28,30,34H,12,14-17,19H2,1-3H3,(H,35,40);4-12,14,23-24,28,30,34H,13,15-19H2,1-3H3,(H,35,40);4-7,10-11,16-17,21,25-26H,2-3,8-9,12-15,18-19,31H2,1H3,(H,33,37);4-7,10-11,16,20,22,24H,2-3,8-9,12-15,17-18,30H2,1H3,(H,32,37).
What are the key properties of 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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide has a molecular weight of 2851.52 g/mol, XLogP of 13.76, 47 rotatable bonds, 10 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 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;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-N-(furo[3,2-c]pyridin-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;1-(2-amino-5-oxo-5-pyrrolidin-1-ylpentanoyl)-4-[(4-methoxyphenyl)methyl]-N-([1,3]thiazolo[4,5-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(2-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;4-[(4-methoxyphenyl)methyl]-N-[(1-methylbenzotriazol-5-yl)methyl]-1-[4-(4-methyl-3-pyridinyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 167652187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).