N-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide

C144H163FN30O25 — CID 160897953

IUPACN-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide
SMILESCCc1ccc(C(=O)NCc2ccnc(-c3ccc(C(=O)N[C@H](C(=O)NC)C4CCCCC4)o3)c2)o1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3cc(C)n(C)n3)ccn2)o1)C(C)C.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3cccc(C)n3)ccn2)o1)C(C)C.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3cccc(F)n3)ccn2)o1)C(C)C.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3ccccn3)ccn2)o1)C(C)C.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3cncc(C)c3)ccn2)o1)C(C)C
InChIInChI=1S/C27H32N4O5.2C24H27N5O4.C23H24FN5O4.C23H28N6O4.C23H25N5O4/c1-3-19-9-10-22(35-19)25(32)30-16-17-13-14-29-20(15-17)21-11-12-23(36-21)26(33)31-24(27(34)28-2)18-7-5-4-6-8-18;1-14(2)21(24(32)25-4)29-23(31)20-6-5-19(33-20)18-10-16(7-8-27-18)12-28-22(30)17-9-15(3)11-26-13-17;1-14(2)21(24(32)25-4)29-23(31)20-9-8-19(33-20)18-12-16(10-11-26-18)13-27-22(30)17-7-5-6-15(3)28-17;1-13(2)20(23(32)25-3)29-22(31)18-8-7-17(33-18)16-11-14(9-10-26-16)12-27-21(30)15-5-4-6-19(24)28-15;1-13(2)20(23(32)24-4)27-22(31)19-7-6-18(33-19)16-11-15(8-9-25-16)12-26-21(30)17-10-14(3)29(5)28-17;1-14(2)20(23(31)24-3)28-22(30)19-8-7-18(32-19)17-12-15(9-11-26-17)13-27-21(29)16-6-4-5-10-25-16/h9-15,18,24H,3-8,16H2,1-2H3,(H,28,34)(H,30,32)(H,31,33);5-11,13-14,21H,12H2,1-4H3,(H,25,32)(H,28,30)(H,29,31);5-12,14,21H,13H2,1-4H3,(H,25,32)(H,27,30)(H,29,31);4-11,13,20H,12H2,1-3H3,(H,25,32)(H,27,30)(H,29,31);6-11,13,20H,12H2,1-5H3,(H,24,32)(H,26,30)(H,27,31);4-12,14,20H,13H2,1-3H3,(H,24,31)(H,27,29)(H,28,30)/t24-;2*21-;3*20-/m000000/s1
InChIKeySPCVPOYLXQLUFI-FHFHXEJLSA-N
MW2733.07 g/mol
LogP15.09
Rot. Bonds49

About N-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide

N-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide (PubChem CID 160897953) has the molecular formula C144H163FN30O25 and a molecular weight of 2733.07 g/mol. Its IUPAC name is N-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide
PubChem CID160897953
Molecular FormulaC144H163FN30O25
Molecular Weight2733.07 g/mol
Exact Mass2731.24
IUPAC NameN-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide
SMILESCCc1ccc(C(=O)NCc2ccnc(-c3ccc(C(=O)N[C@H](C(=O)NC)C4CCCCC4)o3)c2)o1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3cc(C)n(C)n3)ccn2)o1)C(C)C.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3cccc(C)n3)ccn2)o1)C(C)C.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3cccc(F)n3)ccn2)o1)C(C)C.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3ccccn3)ccn2)o1)C(C)C.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3cncc(C)c3)ccn2)o1)C(C)C
InChIInChI=1S/C27H32N4O5.2C24H27N5O4.C23H24FN5O4.C23H28N6O4.C23H25N5O4/c1-3-19-9-10-22(35-19)25(32)30-16-17-13-14-29-20(15-17)21-11-12-23(36-21)26(33)31-24(27(34)28-2)18-7-5-4-6-8-18;1-14(2)21(24(32)25-4)29-23(31)20-6-5-19(33-20)18-10-16(7-8-27-18)12-28-22(30)17-9-15(3)11-26-13-17;1-14(2)21(24(32)25-4)29-23(31)20-9-8-19(33-20)18-12-16(10-11-26-18)13-27-22(30)17-7-5-6-15(3)28-17;1-13(2)20(23(32)25-3)29-22(31)18-8-7-17(33-18)16-11-14(9-10-26-16)12-27-21(30)15-5-4-6-19(24)28-15;1-13(2)20(23(32)24-4)27-22(31)19-7-6-18(33-19)16-11-15(8-9-25-16)12-26-21(30)17-10-14(3)29(5)28-17;1-14(2)20(23(31)24-3)28-22(30)19-8-7-18(32-19)17-12-15(9-11-26-17)13-27-21(29)16-6-4-5-10-25-16/h9-15,18,24H,3-8,16H2,1-2H3,(H,28,34)(H,30,32)(H,31,33);5-11,13-14,21H,12H2,1-4H3,(H,25,32)(H,28,30)(H,29,31);5-12,14,21H,13H2,1-4H3,(H,25,32)(H,27,30)(H,29,31);4-11,13,20H,12H2,1-3H3,(H,25,32)(H,27,30)(H,29,31);6-11,13,20H,12H2,1-5H3,(H,24,32)(H,26,30)(H,27,31);4-12,14,20H,13H2,1-3H3,(H,24,31)(H,27,29)(H,28,30)/t24-;2*21-;3*20-/m000000/s1
InChIKeySPCVPOYLXQLUFI-FHFHXEJLSA-N
XLogP15.09
TPSA762.50 Ų
H-Bond Donors18
H-Bond Acceptors37
Rotatable Bonds49
Heavy Atoms200
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002733.07
LogP ≤ 515.09
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze N-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide?
The IUPAC name of N-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide (CID 160897953) is N-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide?
The canonical SMILES for N-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide is CCc1ccc(C(=O)NCc2ccnc(-c3ccc(C(=O)N[C@H](C(=O)NC)C4CCCCC4)o3)c2)o1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3cc(C)n(C)n3)ccn2)o1)C(C)C.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3cccc(C)n3)ccn2)o1)C(C)C.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3cccc(F)n3)ccn2)o1)C(C)C.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3ccccn3)ccn2)o1)C(C)C.CNC(=O)[C@@H](NC(=O)c1ccc(-c2cc(CNC(=O)c3cncc(C)c3)ccn2)o1)C(C)C.
What is the InChIKey of N-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide?
The InChIKey is SPCVPOYLXQLUFI-FHFHXEJLSA-N. The full InChI is InChI=1S/C27H32N4O5.2C24H27N5O4.C23H24FN5O4.C23H28N6O4.C23H25N5O4/c1-3-19-9-10-22(35-19)25(32)30-16-17-13-14-29-20(15-17)21-11-12-23(36-21)26(33)31-24(27(34)28-2)18-7-5-4-6-8-18;1-14(2)21(24(32)25-4)29-23(31)20-6-5-19(33-20)18-10-16(7-8-27-18)12-28-22(30)17-9-15(3)11-26-13-17;1-14(2)21(24(32)25-4)29-23(31)20-9-8-19(33-20)18-12-16(10-11-26-18)13-27-22(30)17-7-5-6-15(3)28-17;1-13(2)20(23(32)25-3)29-22(31)18-8-7-17(33-18)16-11-14(9-10-26-16)12-27-21(30)15-5-4-6-19(24)28-15;1-13(2)20(23(32)24-4)27-22(31)19-7-6-18(33-19)16-11-15(8-9-25-16)12-26-21(30)17-10-14(3)29(5)28-17;1-14(2)20(23(31)24-3)28-22(30)19-8-7-18(32-19)17-12-15(9-11-26-17)13-27-21(29)16-6-4-5-10-25-16/h9-15,18,24H,3-8,16H2,1-2H3,(H,28,34)(H,30,32)(H,31,33);5-11,13-14,21H,12H2,1-4H3,(H,25,32)(H,28,30)(H,29,31);5-12,14,21H,13H2,1-4H3,(H,25,32)(H,27,30)(H,29,31);4-11,13,20H,12H2,1-3H3,(H,25,32)(H,27,30)(H,29,31);6-11,13,20H,12H2,1-5H3,(H,24,32)(H,26,30)(H,27,31);4-12,14,20H,13H2,1-3H3,(H,24,31)(H,27,29)(H,28,30)/t24-;2*21-;3*20-/m000000/s1.
What are the key properties of N-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide?
N-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide has a molecular weight of 2733.07 g/mol, XLogP of 15.09, 49 rotatable bonds, 18 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]-5-ethylfuran-2-carboxamide;1,5-dimethyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyrazole-3-carboxamide;6-fluoro-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide;5-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-3-carboxamide;6-methyl-N-[[2-[5-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]-4-pyridinyl]methyl]pyridine-2-carboxamide is sourced from PubChem (CID 160897953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).