N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide

C185H218N26O31 — CID 158451093

IUPACN-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide
SMILESCCC(=O)NCc1ccc(-c2ccc(C(=O)N[C@H](C(=O)NC)C3CCCCC3)o2)cc1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3ccc(C)o3)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3ccn(C)n3)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3ccoc3C)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3cncc(C)c3)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3cnn(C)c3)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3occc3C)cc2)o1)C1CCCCC1
InChIInChI=1S/C28H32N4O4.3C27H31N3O5.2C26H31N5O4.C24H31N3O4/c1-18-14-22(17-30-15-18)26(33)31-16-19-8-10-20(11-9-19)23-12-13-24(36-23)27(34)32-25(28(35)29-2)21-6-4-3-5-7-21;1-17-8-13-22(34-17)25(31)29-16-18-9-11-19(12-10-18)21-14-15-23(35-21)26(32)30-24(27(33)28-2)20-6-4-3-5-7-20;1-17-21(14-15-34-17)25(31)29-16-18-8-10-19(11-9-18)22-12-13-23(35-22)26(32)30-24(27(33)28-2)20-6-4-3-5-7-20;1-17-14-15-34-24(17)27(33)29-16-18-8-10-19(11-9-18)21-12-13-22(35-21)25(31)30-23(26(32)28-2)20-6-4-3-5-7-20;1-27-26(34)23(19-6-4-3-5-7-19)30-25(33)22-13-12-21(35-22)18-10-8-17(9-11-18)14-28-24(32)20-15-29-31(2)16-20;1-27-26(34)23(19-6-4-3-5-7-19)29-25(33)22-13-12-21(35-22)18-10-8-17(9-11-18)16-28-24(32)20-14-15-31(2)30-20;1-3-21(28)26-15-16-9-11-17(12-10-16)19-13-14-20(31-19)23(29)27-22(24(30)25-2)18-7-5-4-6-8-18/h8-15,17,21,25H,3-7,16H2,1-2H3,(H,29,35)(H,31,33)(H,32,34);2*8-15,20,24H,3-7,16H2,1-2H3,(H,28,33)(H,29,31)(H,30,32);8-15,20,23H,3-7,16H2,1-2H3,(H,28,32)(H,29,33)(H,30,31);8-13,15-16,19,23H,3-7,14H2,1-2H3,(H,27,34)(H,28,32)(H,30,33);8-15,19,23H,3-7,16H2,1-2H3,(H,27,34)(H,28,32)(H,29,33);9-14,18,22H,3-8,15H2,1-2H3,(H,25,30)(H,26,28)(H,27,29)/t25-;2*24-;3*23-;22-/m0000000/s1
InChIKeyHDZLJORCUUTQSK-BHGZEFIBSA-N
MW3301.93 g/mol
LogP26.08
Rot. Bonds56

About N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide

N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide (PubChem CID 158451093) has the molecular formula C185H218N26O31 and a molecular weight of 3301.93 g/mol. Its IUPAC name is N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide
PubChem CID158451093
Molecular FormulaC185H218N26O31
Molecular Weight3301.93 g/mol
Exact Mass3299.63
IUPAC NameN-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide
SMILESCCC(=O)NCc1ccc(-c2ccc(C(=O)N[C@H](C(=O)NC)C3CCCCC3)o2)cc1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3ccc(C)o3)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3ccn(C)n3)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3ccoc3C)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3cncc(C)c3)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3cnn(C)c3)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3occc3C)cc2)o1)C1CCCCC1
InChIInChI=1S/C28H32N4O4.3C27H31N3O5.2C26H31N5O4.C24H31N3O4/c1-18-14-22(17-30-15-18)26(33)31-16-19-8-10-20(11-9-19)23-12-13-24(36-23)27(34)32-25(28(35)29-2)21-6-4-3-5-7-21;1-17-8-13-22(34-17)25(31)29-16-18-9-11-19(12-10-18)21-14-15-23(35-21)26(32)30-24(27(33)28-2)20-6-4-3-5-7-20;1-17-21(14-15-34-17)25(31)29-16-18-8-10-19(11-9-18)22-12-13-23(35-22)26(32)30-24(27(33)28-2)20-6-4-3-5-7-20;1-17-14-15-34-24(17)27(33)29-16-18-8-10-19(11-9-18)21-12-13-22(35-21)25(31)30-23(26(32)28-2)20-6-4-3-5-7-20;1-27-26(34)23(19-6-4-3-5-7-19)30-25(33)22-13-12-21(35-22)18-10-8-17(9-11-18)14-28-24(32)20-15-29-31(2)16-20;1-27-26(34)23(19-6-4-3-5-7-19)29-25(33)22-13-12-21(35-22)18-10-8-17(9-11-18)16-28-24(32)20-14-15-31(2)30-20;1-3-21(28)26-15-16-9-11-17(12-10-16)19-13-14-20(31-19)23(29)27-22(24(30)25-2)18-7-5-4-6-8-18/h8-15,17,21,25H,3-7,16H2,1-2H3,(H,29,35)(H,31,33)(H,32,34);2*8-15,20,24H,3-7,16H2,1-2H3,(H,28,33)(H,29,31)(H,30,32);8-15,20,23H,3-7,16H2,1-2H3,(H,28,32)(H,29,33)(H,30,31);8-13,15-16,19,23H,3-7,14H2,1-2H3,(H,27,34)(H,28,32)(H,30,33);8-15,19,23H,3-7,16H2,1-2H3,(H,27,34)(H,28,32)(H,29,33);9-14,18,22H,3-8,15H2,1-2H3,(H,25,30)(H,26,28)(H,27,29)/t25-;2*24-;3*23-;22-/m0000000/s1
InChIKeyHDZLJORCUUTQSK-BHGZEFIBSA-N
XLogP26.08
TPSA791.03 Ų
H-Bond Donors21
H-Bond Acceptors36
Rotatable Bonds56
Heavy Atoms242
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003301.93
LogP ≤ 526.08
H-Bond Donors ≤ 521
H-Bond Acceptors ≤ 1036

Analyze N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide (CID 158451093) is N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide is CCC(=O)NCc1ccc(-c2ccc(C(=O)N[C@H](C(=O)NC)C3CCCCC3)o2)cc1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3ccc(C)o3)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3ccn(C)n3)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3ccoc3C)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3cncc(C)c3)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3cnn(C)c3)cc2)o1)C1CCCCC1.CNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(CNC(=O)c3occc3C)cc2)o1)C1CCCCC1.
What is the InChIKey of N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide?
The InChIKey is HDZLJORCUUTQSK-BHGZEFIBSA-N. The full InChI is InChI=1S/C28H32N4O4.3C27H31N3O5.2C26H31N5O4.C24H31N3O4/c1-18-14-22(17-30-15-18)26(33)31-16-19-8-10-20(11-9-19)23-12-13-24(36-23)27(34)32-25(28(35)29-2)21-6-4-3-5-7-21;1-17-8-13-22(34-17)25(31)29-16-18-9-11-19(12-10-18)21-14-15-23(35-21)26(32)30-24(27(33)28-2)20-6-4-3-5-7-20;1-17-21(14-15-34-17)25(31)29-16-18-8-10-19(11-9-18)22-12-13-23(35-22)26(32)30-24(27(33)28-2)20-6-4-3-5-7-20;1-17-14-15-34-24(17)27(33)29-16-18-8-10-19(11-9-18)21-12-13-22(35-21)25(31)30-23(26(32)28-2)20-6-4-3-5-7-20;1-27-26(34)23(19-6-4-3-5-7-19)30-25(33)22-13-12-21(35-22)18-10-8-17(9-11-18)14-28-24(32)20-15-29-31(2)16-20;1-27-26(34)23(19-6-4-3-5-7-19)29-25(33)22-13-12-21(35-22)18-10-8-17(9-11-18)16-28-24(32)20-14-15-31(2)30-20;1-3-21(28)26-15-16-9-11-17(12-10-16)19-13-14-20(31-19)23(29)27-22(24(30)25-2)18-7-5-4-6-8-18/h8-15,17,21,25H,3-7,16H2,1-2H3,(H,29,35)(H,31,33)(H,32,34);2*8-15,20,24H,3-7,16H2,1-2H3,(H,28,33)(H,29,31)(H,30,32);8-15,20,23H,3-7,16H2,1-2H3,(H,28,32)(H,29,33)(H,30,31);8-13,15-16,19,23H,3-7,14H2,1-2H3,(H,27,34)(H,28,32)(H,30,33);8-15,19,23H,3-7,16H2,1-2H3,(H,27,34)(H,28,32)(H,29,33);9-14,18,22H,3-8,15H2,1-2H3,(H,25,30)(H,26,28)(H,27,29)/t25-;2*24-;3*23-;22-/m0000000/s1.
What are the key properties of N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide?
N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide has a molecular weight of 3301.93 g/mol, XLogP of 26.08, 56 rotatable bonds, 21 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-2-methylfuran-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-3-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylfuran-2-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-3-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-1-methylpyrazole-4-carboxamide;N-[[4-[5-[[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-5-methylpyridine-3-carboxamide;N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]-5-[4-[(propanoylamino)methyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 158451093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).