N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide

C155H168F3N25O28S8 — CID 157458745

IUPACN-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide
SMILESCC(C)CN(CCCN(CCn1ccnc1)S(=O)(=O)c1ccc2occc2c1)C(=O)CC(C)(C)C.CC(C)CN(CCCN(CCn1ccnc1)S(=O)(=O)c1ccc2occc2c1)S(=O)(=O)c1ccc2occc2c1.O=C(NCCCN(Cc1ccncc1)S(=O)(=O)c1ccc2occc2c1)C(F)(F)F.O=S(=O)(NCCCN(CCn1ccnc1)S(=O)(=O)c1ccc2occc2c1)c1ccc2occc2c1.O=S(=O)(c1ccc2occc2c1)N(CCCN(CCn1ccnc1)S(=O)(=O)c1ccc2occc2c1)CCn1ccnc1.c1cc(CNCc2ccc3occc3c2)ccn1.c1cc(NCc2ccc3occc3c2)ccn1
InChIInChI=1S/C29H30N6O6S2.C28H32N4O6S2.C26H38N4O4S.C24H24N4O6S2.C19H18F3N3O4S.C15H14N2O.C14H12N2O/c36-42(37,26-2-4-28-24(20-26)6-18-40-28)34(16-14-32-12-8-30-22-32)10-1-11-35(17-15-33-13-9-31-23-33)43(38,39)27-3-5-29-25(21-27)7-19-41-29;1-22(2)20-32(40(35,36)26-5-7-28-24(19-26)9-17-38-28)12-3-11-31(15-14-30-13-10-29-21-30)39(33,34)25-4-6-27-23(18-25)8-16-37-27;1-21(2)19-29(25(31)18-26(3,4)5)11-6-12-30(15-14-28-13-10-27-20-28)35(32,33)23-7-8-24-22(17-23)9-16-34-24;29-35(30,21-2-4-23-19(16-21)6-14-33-23)26-8-1-10-28(13-12-27-11-9-25-18-27)36(31,32)22-3-5-24-20(17-22)7-15-34-24;20-19(21,22)18(26)24-7-1-10-25(13-14-4-8-23-9-5-14)30(27,28)16-2-3-17-15(12-16)6-11-29-17;1-2-15-14(5-8-18-15)9-13(1)11-17-10-12-3-6-16-7-4-12;1-2-14-12(5-8-17-14)9-11(1)10-16-13-3-6-15-7-4-13/h2-9,12-13,18-23H,1,10-11,14-17H2;4-10,13,16-19,21-22H,3,11-12,14-15,20H2,1-2H3;7-10,13,16-17,20-21H,6,11-12,14-15,18-19H2,1-5H3;2-7,9,11,14-18,26H,1,8,10,12-13H2;2-6,8-9,11-12H,1,7,10,13H2,(H,24,26);1-9,17H,10-11H2;1-9H,10H2,(H,15,16)
InChIKeyBTRCHUWCNRRFPJ-UHFFFAOYSA-N
MW3142.73 g/mol
LogP26.56
Rot. Bonds65

About N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide

N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide (PubChem CID 157458745) has the molecular formula C155H168F3N25O28S8 and a molecular weight of 3142.73 g/mol. Its IUPAC name is N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide.

Molecular Properties

Compound NameN-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide
PubChem CID157458745
Molecular FormulaC155H168F3N25O28S8
Molecular Weight3142.73 g/mol
Exact Mass3140.02
IUPAC NameN-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide
SMILESCC(C)CN(CCCN(CCn1ccnc1)S(=O)(=O)c1ccc2occc2c1)C(=O)CC(C)(C)C.CC(C)CN(CCCN(CCn1ccnc1)S(=O)(=O)c1ccc2occc2c1)S(=O)(=O)c1ccc2occc2c1.O=C(NCCCN(Cc1ccncc1)S(=O)(=O)c1ccc2occc2c1)C(F)(F)F.O=S(=O)(NCCCN(CCn1ccnc1)S(=O)(=O)c1ccc2occc2c1)c1ccc2occc2c1.O=S(=O)(c1ccc2occc2c1)N(CCCN(CCn1ccnc1)S(=O)(=O)c1ccc2occc2c1)CCn1ccnc1.c1cc(CNCc2ccc3occc3c2)ccn1.c1cc(NCc2ccc3occc3c2)ccn1
InChIInChI=1S/C29H30N6O6S2.C28H32N4O6S2.C26H38N4O4S.C24H24N4O6S2.C19H18F3N3O4S.C15H14N2O.C14H12N2O/c36-42(37,26-2-4-28-24(20-26)6-18-40-28)34(16-14-32-12-8-30-22-32)10-1-11-35(17-15-33-13-9-31-23-33)43(38,39)27-3-5-29-25(21-27)7-19-41-29;1-22(2)20-32(40(35,36)26-5-7-28-24(19-26)9-17-38-28)12-3-11-31(15-14-30-13-10-29-21-30)39(33,34)25-4-6-27-23(18-25)8-16-37-27;1-21(2)19-29(25(31)18-26(3,4)5)11-6-12-30(15-14-28-13-10-27-20-28)35(32,33)23-7-8-24-22(17-23)9-16-34-24;29-35(30,21-2-4-23-19(16-21)6-14-33-23)26-8-1-10-28(13-12-27-11-9-25-18-27)36(31,32)22-3-5-24-20(17-22)7-15-34-24;20-19(21,22)18(26)24-7-1-10-25(13-14-4-8-23-9-5-14)30(27,28)16-2-3-17-15(12-16)6-11-29-17;1-2-15-14(5-8-18-15)9-13(1)11-17-10-12-3-6-16-7-4-12;1-2-14-12(5-8-17-14)9-11(1)10-16-13-3-6-15-7-4-13/h2-9,12-13,18-23H,1,10-11,14-17H2;4-10,13,16-19,21-22H,3,11-12,14-15,20H2,1-2H3;7-10,13,16-17,20-21H,6,11-12,14-15,18-19H2,1-5H3;2-7,9,11,14-18,26H,1,8,10,12-13H2;2-6,8-9,11-12H,1,7,10,13H2,(H,24,26);1-9,17H,10-11H2;1-9H,10H2,(H,15,16)
InChIKeyBTRCHUWCNRRFPJ-UHFFFAOYSA-N
XLogP26.56
TPSA640.47 Ų
H-Bond Donors4
H-Bond Acceptors43
Rotatable Bonds65
Heavy Atoms219
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003142.73
LogP ≤ 526.56
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1043

Computed Properties (RDKit)

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

Analyze N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide with MolForge

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Related Compounds

1-[(2S)-1-(1-benzofuran-2-ylsulfonyl)pyrrolidin-2-yl]-3-[3-[5-(trifluoromethyl)pyrazin-2-yl]phenyl]propan-1-one;bis(1-[(2S)-1-(1-benzofuran-2-ylsulfonyl)pyrrolidin-2-yl]-3-[4-[5-(trifluoromethyl)-2-pyridinyl]-2-pyridinyl]propan-1-one);1-[(2S)-1-(1-benzofuran-2-ylsulfonyl)pyrrolidin-2-yl]-3-[2-[2-(trifluoromethyl)pyrimidin-5-yl]-4-pyridinyl]propan-1-one;1-[(2S)-1-(1-benzofuran-2-ylsulfonyl)pyrrolidin-2-yl]-3-[4-[5-(trifluoromethyl)pyrimidin-2-yl]-2-pyridinyl]propan-1-one;5-fluoro-N-[(2S)-5-[2-[2-hydroxy-4-(trifluoromethyl)phenyl]-4-pyridinyl]-3-oxopentan-2-yl]-1-benzofuran-2-sulfonamide;5-fluoro-N-[(2S)-3-oxo-5-[6-[4-(trifluoromethoxy)phenyl]pyrimidin-4-yl]pentan-2-yl]-1-benzofuran-2-sulfonamide;5-fluoro-N-[(2S)-3-oxo-5-[6-[6-(trifluoromethyl)-3-pyridinyl]pyrimidin-4-yl]pentan-2-yl]-1-benzofuran-2-sulfonamide
CID 159024383
N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl 2,2-dimethylpropanoate;N-(pyridin-4-ylmethyl)-N-(6,6,6-trifluoro-5-oxohexyl)-1-benzofuran-5-sulfonamide
CID 160348392
N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-(pyridin-4-ylmethyl)-N-(6,6,6-trifluoro-5-oxohexyl)-1-benzofuran-5-sulfonamide
CID 160590621
CID 161573940
CID 161573940
N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[4-(1-benzofuran-5-ylsulfonyl)butyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-N-(2-methylpropyl)acetamide;N-[3-[bis(2-methylpropyl)amino]propyl]-N-(pyridin-4-ylmethyl)-1-benzofuran-5-sulfonamide
CID 157119653
4-(1-benzofuran-5-ylsulfonyl)-2,2-dimethyl-N-(2-methylpropyl)butan-1-amine;N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-3-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-(7,7-dimethyl-5-oxooctyl)-N-(2-methylpropyl)-1-benzofuran-5-sulfonamide
CID 157519143
3-(1-benzofuran-5-yl)-2-(1-benzofuran-5-ylmethylamino)-N,N-bis(2-methylpropyl)propanamide;N-(1-benzofuran-5-ylmethyl)-2-[1-benzofuran-5-ylsulfonyl-[(3-methylimidazol-4-yl)methyl]amino]-N-(2-methylpropyl)acetamide;(2S)-2-(1-benzofuran-5-ylsulfonylamino)-3-(1-methylimidazol-4-yl)-N,N-bis(2-methylpropyl)propanamide;2-[1-benzofuran-5-ylsulfonyl-[(2,5-dimethylpyrazol-3-yl)methyl]amino]-2-methyl-N,N-bis(2-methylpropyl)propanamide;(2S)-2-[1-benzofuran-5-ylsulfonyl(methyl)amino]-3-(3-methylimidazol-4-yl)-N,N-bis(2-methylpropyl)propanamide
CID 158019188
N-(1-benzofuran-5-ylmethyl)-N-(pyridin-4-ylmethyl)-1-benzofuran-5-sulfonamide;1-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-3-tert-butylurea;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-N-(2-methylpropyl)acetamide;N-[3-[bis(2-methylpropyl)amino]propyl]-N-(pyridin-4-ylmethyl)-1-benzofuran-5-sulfonamide;N-(4-phenylbutyl)-N-(pyridin-4-ylmethyl)-1-benzofuran-5-sulfonamide
CID 158078511
1-[(1S)-1-[1-(1-benzofuran-5-yl)imidazol-2-yl]-2-phenylethyl]-3-(2-fluorophenyl)sulfonylurea;1-[(1S)-1-[1-(1-benzylpyrazol-4-yl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-2-(3,5-difluorophenyl)-1-[1-(2,3-dihydro-1-benzofuran-5-yl)imidazol-2-yl]ethyl]-3-(2-methylphenyl)sulfonylurea;1-(2-methylphenyl)sulfonyl-3-[(1S)-1-[1-[3-(2-oxopentyl)phenyl]imidazol-2-yl]-2-phenylethyl]urea;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(1-phenylpyrrol-3-yl)imidazol-2-yl]ethyl]urea
CID 159112645
N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;bis(N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-2-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide);N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-3-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;tert-butyl N-[(2R)-1-[1-benzofuran-5-ylmethyl(pyridin-4-ylmethyl)amino]-1-oxo-3-phenylpropan-2-yl]carbamate
CID 159174129
N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[4-(1-benzofuran-5-ylsulfonyl)butyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-N-(2-methylpropyl)acetamide;N-[3-[bis(2-methylpropyl)amino]propyl]-N-(pyridin-4-ylmethyl)-1-benzofuran-5-sulfonamide;N-(4-phenylbutyl)-N-(pyridin-4-ylmethyl)-1-benzofuran-5-sulfonamide
CID 160262931
N-[3-[1-benzofuran-5-ylsulfonyl(imidazo[1,2-a]pyridin-6-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]-2,2-dimethylpropyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-3,3-dimethylbutanamide;bis(N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-3-ylmethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide);N-[2,2-dimethyl-3-(2-methylpropylamino)propyl]-1-benzofuran-5-sulfonamide
CID 160376651

Frequently Asked Questions

What is the IUPAC name of N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide?
The IUPAC name of N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide (CID 157458745) is N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide.
What is the SMILES notation for N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide?
The canonical SMILES for N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide is CC(C)CN(CCCN(CCn1ccnc1)S(=O)(=O)c1ccc2occc2c1)C(=O)CC(C)(C)C.CC(C)CN(CCCN(CCn1ccnc1)S(=O)(=O)c1ccc2occc2c1)S(=O)(=O)c1ccc2occc2c1.O=C(NCCCN(Cc1ccncc1)S(=O)(=O)c1ccc2occc2c1)C(F)(F)F.O=S(=O)(NCCCN(CCn1ccnc1)S(=O)(=O)c1ccc2occc2c1)c1ccc2occc2c1.O=S(=O)(c1ccc2occc2c1)N(CCCN(CCn1ccnc1)S(=O)(=O)c1ccc2occc2c1)CCn1ccnc1.c1cc(CNCc2ccc3occc3c2)ccn1.c1cc(NCc2ccc3occc3c2)ccn1.
What is the InChIKey of N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide?
The InChIKey is BTRCHUWCNRRFPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H30N6O6S2.C28H32N4O6S2.C26H38N4O4S.C24H24N4O6S2.C19H18F3N3O4S.C15H14N2O.C14H12N2O/c36-42(37,26-2-4-28-24(20-26)6-18-40-28)34(16-14-32-12-8-30-22-32)10-1-11-35(17-15-33-13-9-31-23-33)43(38,39)27-3-5-29-25(21-27)7-19-41-29;1-22(2)20-32(40(35,36)26-5-7-28-24(19-26)9-17-38-28)12-3-11-31(15-14-30-13-10-29-21-30)39(33,34)25-4-6-27-23(18-25)8-16-37-27;1-21(2)19-29(25(31)18-26(3,4)5)11-6-12-30(15-14-28-13-10-27-20-28)35(32,33)23-7-8-24-22(17-23)9-16-34-24;29-35(30,21-2-4-23-19(16-21)6-14-33-23)26-8-1-10-28(13-12-27-11-9-25-18-27)36(31,32)22-3-5-24-20(17-22)7-15-34-24;20-19(21,22)18(26)24-7-1-10-25(13-14-4-8-23-9-5-14)30(27,28)16-2-3-17-15(12-16)6-11-29-17;1-2-15-14(5-8-18-15)9-13(1)11-17-10-12-3-6-16-7-4-12;1-2-14-12(5-8-17-14)9-11(1)10-16-13-3-6-15-7-4-13/h2-9,12-13,18-23H,1,10-11,14-17H2;4-10,13,16-19,21-22H,3,11-12,14-15,20H2,1-2H3;7-10,13,16-17,20-21H,6,11-12,14-15,18-19H2,1-5H3;2-7,9,11,14-18,26H,1,8,10,12-13H2;2-6,8-9,11-12H,1,7,10,13H2,(H,24,26);1-9,17H,10-11H2;1-9H,10H2,(H,15,16).
What are the key properties of N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide?
N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide has a molecular weight of 3142.73 g/mol, XLogP of 26.56, 65 rotatable bonds, 4 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzofuran-5-ylmethyl)pyridin-4-amine;N-(1-benzofuran-5-ylmethyl)-1-pyridin-4-ylmethanamine;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-3,3-dimethyl-N-(2-methylpropyl)butanamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-imidazol-1-ylethyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]propyl]-N-(2-imidazol-1-ylethyl)-1-benzofuran-5-sulfonamide;N-[3-[1-benzofuran-5-ylsulfonyl(pyridin-4-ylmethyl)amino]propyl]-2,2,2-trifluoroacetamide is sourced from PubChem (CID 157458745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).