N-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide

C119H119ClF4N30O15 — CID 157206682

IUPACN-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide
SMILESCc1c(C(=O)C(=O)NC2(c3cn[nH]n3)CC2)c2n(c1C(=O)Nc1cccc(C(C)F)c1)CCC2.Cc1cc(Cl)cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(c4cn[nH]n4)CC3)c3n2CCC3)c1.Cc1cc(F)cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(c4cn[nH]n4)CC3)c3n2CCC3)c1.Cc1ccc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(c4cn[nH]n4)CC(F)(F)C3)c3n2[C@@H]2C[C@@H]2C3)cc1.Cc1ccc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(c4cn[nH]n4)CC3)c3n2[C@@H]2C[C@@H]2C3)cc1
InChIInChI=1S/C25H24F2N6O3.C24H25FN6O3.C24H24N6O3.C23H23ClN6O3.C23H23FN6O3/c1-12-3-5-15(6-4-12)29-22(35)20-13(2)19(17-8-14-7-16(14)33(17)20)21(34)23(36)30-24(10-25(26,27)11-24)18-9-28-32-31-18;1-13-19(21(32)23(34)28-24(8-9-24)18-12-26-30-29-18)17-7-4-10-31(17)20(13)22(33)27-16-6-3-5-15(11-16)14(2)25;1-12-3-5-15(6-4-12)26-22(32)20-13(2)19(17-10-14-9-16(14)30(17)20)21(31)23(33)27-24(7-8-24)18-11-25-29-28-18;2*1-12-8-14(24)10-15(9-12)26-21(32)19-13(2)18(16-4-3-7-30(16)19)20(31)22(33)27-23(5-6-23)17-11-25-29-28-17/h3-6,9,14,16H,7-8,10-11H2,1-2H3,(H,29,35)(H,30,36)(H,28,31,32);3,5-6,11-12,14H,4,7-10H2,1-2H3,(H,27,33)(H,28,34)(H,26,29,30);3-6,11,14,16H,7-10H2,1-2H3,(H,26,32)(H,27,33)(H,25,28,29);2*8-11H,3-7H2,1-2H3,(H,26,32)(H,27,33)(H,25,28,29)/t14-,16-;;14-,16-;;/m1.1../s1
InChIKeyARKZTCNUDNNCSI-QALGVECQSA-N
MW2320.90 g/mol
LogP14.54
Rot. Bonds31

About N-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide

N-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide (PubChem CID 157206682) has the molecular formula C119H119ClF4N30O15 and a molecular weight of 2320.90 g/mol. Its IUPAC name is N-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide
PubChem CID157206682
Molecular FormulaC119H119ClF4N30O15
Molecular Weight2320.90 g/mol
Exact Mass2318.91
IUPAC NameN-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide
SMILESCc1c(C(=O)C(=O)NC2(c3cn[nH]n3)CC2)c2n(c1C(=O)Nc1cccc(C(C)F)c1)CCC2.Cc1cc(Cl)cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(c4cn[nH]n4)CC3)c3n2CCC3)c1.Cc1cc(F)cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(c4cn[nH]n4)CC3)c3n2CCC3)c1.Cc1ccc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(c4cn[nH]n4)CC(F)(F)C3)c3n2[C@@H]2C[C@@H]2C3)cc1.Cc1ccc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(c4cn[nH]n4)CC3)c3n2[C@@H]2C[C@@H]2C3)cc1
InChIInChI=1S/C25H24F2N6O3.C24H25FN6O3.C24H24N6O3.C23H23ClN6O3.C23H23FN6O3/c1-12-3-5-15(6-4-12)29-22(35)20-13(2)19(17-8-14-7-16(14)33(17)20)21(34)23(36)30-24(10-25(26,27)11-24)18-9-28-32-31-18;1-13-19(21(32)23(34)28-24(8-9-24)18-12-26-30-29-18)17-7-4-10-31(17)20(13)22(33)27-16-6-3-5-15(11-16)14(2)25;1-12-3-5-15(6-4-12)26-22(32)20-13(2)19(17-10-14-9-16(14)30(17)20)21(31)23(33)27-24(7-8-24)18-11-25-29-28-18;2*1-12-8-14(24)10-15(9-12)26-21(32)19-13(2)18(16-4-3-7-30(16)19)20(31)22(33)27-23(5-6-23)17-11-25-29-28-17/h3-6,9,14,16H,7-8,10-11H2,1-2H3,(H,29,35)(H,30,36)(H,28,31,32);3,5-6,11-12,14H,4,7-10H2,1-2H3,(H,27,33)(H,28,34)(H,26,29,30);3-6,11,14,16H,7-10H2,1-2H3,(H,26,32)(H,27,33)(H,25,28,29);2*8-11H,3-7H2,1-2H3,(H,26,32)(H,27,33)(H,25,28,29)/t14-,16-;;14-,16-;;/m1.1../s1
InChIKeyARKZTCNUDNNCSI-QALGVECQSA-N
XLogP14.54
TPSA608.85 Ų
H-Bond Donors15
H-Bond Acceptors30
Rotatable Bonds31
Heavy Atoms169
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002320.90
LogP ≤ 514.54
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze N-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide?
The IUPAC name of N-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide (CID 157206682) is N-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide.
What is the SMILES notation for N-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide?
The canonical SMILES for N-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide is Cc1c(C(=O)C(=O)NC2(c3cn[nH]n3)CC2)c2n(c1C(=O)Nc1cccc(C(C)F)c1)CCC2.Cc1cc(Cl)cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(c4cn[nH]n4)CC3)c3n2CCC3)c1.Cc1cc(F)cc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(c4cn[nH]n4)CC3)c3n2CCC3)c1.Cc1ccc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(c4cn[nH]n4)CC(F)(F)C3)c3n2[C@@H]2C[C@@H]2C3)cc1.Cc1ccc(NC(=O)c2c(C)c(C(=O)C(=O)NC3(c4cn[nH]n4)CC3)c3n2[C@@H]2C[C@@H]2C3)cc1.
What is the InChIKey of N-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide?
The InChIKey is ARKZTCNUDNNCSI-QALGVECQSA-N. The full InChI is InChI=1S/C25H24F2N6O3.C24H25FN6O3.C24H24N6O3.C23H23ClN6O3.C23H23FN6O3/c1-12-3-5-15(6-4-12)29-22(35)20-13(2)19(17-8-14-7-16(14)33(17)20)21(34)23(36)30-24(10-25(26,27)11-24)18-9-28-32-31-18;1-13-19(21(32)23(34)28-24(8-9-24)18-12-26-30-29-18)17-7-4-10-31(17)20(13)22(33)27-16-6-3-5-15(11-16)14(2)25;1-12-3-5-15(6-4-12)26-22(32)20-13(2)19(17-10-14-9-16(14)30(17)20)21(31)23(33)27-24(7-8-24)18-11-25-29-28-18;2*1-12-8-14(24)10-15(9-12)26-21(32)19-13(2)18(16-4-3-7-30(16)19)20(31)22(33)27-23(5-6-23)17-11-25-29-28-17/h3-6,9,14,16H,7-8,10-11H2,1-2H3,(H,29,35)(H,30,36)(H,28,31,32);3,5-6,11-12,14H,4,7-10H2,1-2H3,(H,27,33)(H,28,34)(H,26,29,30);3-6,11,14,16H,7-10H2,1-2H3,(H,26,32)(H,27,33)(H,25,28,29);2*8-11H,3-7H2,1-2H3,(H,26,32)(H,27,33)(H,25,28,29)/t14-,16-;;14-,16-;;/m1.1../s1.
What are the key properties of N-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide?
N-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide has a molecular weight of 2320.90 g/mol, XLogP of 14.54, 31 rotatable bonds, 15 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-7-[2-[[3,3-difluoro-1-(2H-triazol-4-yl)cyclobutyl]amino]-2-oxoacetyl]-8-methyl-N-(4-methylphenyl)-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide;N-[3-(1-fluoroethyl)phenyl]-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-2-methyl-1-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-6,7-dihydro-5H-pyrrolizine-3-carboxamide;(2R,4R)-8-methyl-N-(4-methylphenyl)-7-[2-oxo-2-[[1-(2H-triazol-4-yl)cyclopropyl]amino]acetyl]-1-azatricyclo[4.3.0.02,4]nona-6,8-diene-9-carboxamide is sourced from PubChem (CID 157206682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).