1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide

C148H146F2N16O18 — CID 158635865

IUPAC1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide
SMILESCC(C)(C)c1cc2cc(NC(=O)C3(c4ccc5c(c4)OC(F)(F)O5)CC3)ccc2n1CCc1nn[nH]n1.CC(C)(C)c1cc2cc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)ccc2n1C1CCOC1.CC(C)(C)c1cc2cc(NC(=O)C3(c4ccc5ccoc5c4)CC3)ccc2[nH]1.CC(C)(C)c1cc2cc(NC(=O)C3(c4ccc5occc5c4)CC3)ccc2[nH]1.CC(C)(O)c1cc2cc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)ccc2[nH]1.O=C(Nc1ccc2[nH]c(-c3ccccc3)cc2c1)C1(c2ccc3c(c2)OCO3)CC1
InChIInChI=1S/C27H30N2O4.C26H26F2N6O3.C25H20N2O3.2C24H24N2O2.C22H22N2O4/c1-26(2,3)24-13-17-12-19(5-6-21(17)29(24)20-8-11-31-15-20)28-25(30)27(9-10-27)18-4-7-22-23(14-18)33-16-32-22;1-24(2,3)21-13-15-12-17(5-6-18(15)34(21)11-8-22-30-32-33-31-22)29-23(35)25(9-10-25)16-4-7-19-20(14-16)37-26(27,28)36-19;28-24(25(10-11-25)18-6-9-22-23(14-18)30-15-29-22)26-19-7-8-20-17(12-19)13-21(27-20)16-4-2-1-3-5-16;1-23(2,3)21-14-16-13-18(5-6-19(16)26-21)25-22(27)24(9-10-24)17-4-7-20-15(12-17)8-11-28-20;1-23(2,3)21-13-16-12-18(6-7-19(16)26-21)25-22(27)24(9-10-24)17-5-4-15-8-11-28-20(15)14-17;1-21(2,26)19-10-13-9-15(4-5-16(13)24-19)23-20(25)22(7-8-22)14-3-6-17-18(11-14)28-12-27-17/h4-7,12-14,20H,8-11,15-16H2,1-3H3,(H,28,30);4-7,12-14H,8-11H2,1-3H3,(H,29,35)(H,30,31,32,33);1-9,12-14,27H,10-11,15H2,(H,26,28);2*4-8,11-14,26H,9-10H2,1-3H3,(H,25,27);3-6,9-11,24,26H,7-8,12H2,1-2H3,(H,23,25)
InChIKeyHZTLZXXBCDBFEX-UHFFFAOYSA-N
MW2474.89 g/mol
LogP30.78
Rot. Bonds24

About 1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide

1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide (PubChem CID 158635865) has the molecular formula C148H146F2N16O18 and a molecular weight of 2474.89 g/mol. Its IUPAC name is 1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide
PubChem CID158635865
Molecular FormulaC148H146F2N16O18
Molecular Weight2474.89 g/mol
Exact Mass2473.10
IUPAC Name1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide
SMILESCC(C)(C)c1cc2cc(NC(=O)C3(c4ccc5c(c4)OC(F)(F)O5)CC3)ccc2n1CCc1nn[nH]n1.CC(C)(C)c1cc2cc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)ccc2n1C1CCOC1.CC(C)(C)c1cc2cc(NC(=O)C3(c4ccc5ccoc5c4)CC3)ccc2[nH]1.CC(C)(C)c1cc2cc(NC(=O)C3(c4ccc5occc5c4)CC3)ccc2[nH]1.CC(C)(O)c1cc2cc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)ccc2[nH]1.O=C(Nc1ccc2[nH]c(-c3ccccc3)cc2c1)C1(c2ccc3c(c2)OCO3)CC1
InChIInChI=1S/C27H30N2O4.C26H26F2N6O3.C25H20N2O3.2C24H24N2O2.C22H22N2O4/c1-26(2,3)24-13-17-12-19(5-6-21(17)29(24)20-8-11-31-15-20)28-25(30)27(9-10-27)18-4-7-22-23(14-18)33-16-32-22;1-24(2,3)21-13-15-12-17(5-6-18(15)34(21)11-8-22-30-32-33-31-22)29-23(35)25(9-10-25)16-4-7-19-20(14-16)37-26(27,28)36-19;28-24(25(10-11-25)18-6-9-22-23(14-18)30-15-29-22)26-19-7-8-20-17(12-19)13-21(27-20)16-4-2-1-3-5-16;1-23(2,3)21-14-16-13-18(5-6-19(16)26-21)25-22(27)24(9-10-24)17-4-7-20-15(12-17)8-11-28-20;1-23(2,3)21-13-16-12-18(6-7-19(16)26-21)25-22(27)24(9-10-24)17-5-4-15-8-11-28-20(15)14-17;1-21(2,26)19-10-13-9-15(4-5-16(13)24-19)23-20(25)22(7-8-22)14-3-6-17-18(11-14)28-12-27-17/h4-7,12-14,20H,8-11,15-16H2,1-3H3,(H,28,30);4-7,12-14H,8-11H2,1-3H3,(H,29,35)(H,30,31,32,33);1-9,12-14,27H,10-11,15H2,(H,26,28);2*4-8,11-14,26H,9-10H2,1-3H3,(H,25,27);3-6,9-11,24,26H,7-8,12H2,1-2H3,(H,23,25)
InChIKeyHZTLZXXBCDBFEX-UHFFFAOYSA-N
XLogP30.78
TPSA431.66 Ų
H-Bond Donors12
H-Bond Acceptors23
Rotatable Bonds24
Heavy Atoms184
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002474.89
LogP ≤ 530.78
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1023

Analyze 1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-N-(2-hydroxyethyl)-1H-indole-2-carboxamide;5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-N-propan-2-yl-1H-indole-2-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-[2-methyl-1-(methylamino)-1-oxopropan-2-yl]-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-[2-methyl-4-(2H-tetrazol-5-yl)butan-2-yl]-1H-indol-5-yl]cyclopropane-1-carboxamide;N-(2-tert-butyl-1H-indol-5-yl)-1-(4-chloro-3-phenylmethoxyphenyl)cyclopropane-1-carboxamide;N-(2-tert-butyl-1H-indol-5-yl)-1-[3-(hydroxymethyl)-4-methoxyphenyl]cyclopropane-1-carboxamide;N-(2-tert-butyl-1H-indol-5-yl)-1-[4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;molecular hydrogen
CID 157254229
1-(1,3-benzodioxol-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[7-fluoro-2-(1-methylcyclopropyl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-pyridin-4-yl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-(1,3-dihydroxypropan-2-yl)indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;N-(2-tert-butyl-1H-indol-5-yl)-1-(2,3-dihydro-1-benzofuran-6-yl)cyclopropane-1-carboxamide;1-(4-methoxyphenyl)-N-[2-(1-methylcyclopropyl)-1H-indol-5-yl]cyclopropane-1-carboxamide;methyl 5-[[1-(1,3-benzodioxol-5-yl)cyclopropanecarbonyl]amino]-2-tert-butyl-1H-indole-7-carboxylate
CID 157411179
1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(3-ethoxy-2-hydroxypropyl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-6-fluoro-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]cyclopropane-1-carboxamide;5-[2-[1-(1,3-benzodioxol-5-yl)cyclopropyl]-2-oxoethyl]-2-tert-butyl-1H-indole-3-carbonitrile;1-(1,3-benzodioxol-5-yl)-N-[6-fluoro-2-(1-methylcyclopropyl)-1H-indol-5-yl]cyclopropane-1-carboxamide;2-(1-tert-butylindol-5-yl)-1-[1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropyl]ethanone
CID 159847294
1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;molecular hydrogen
CID 160023352
1-(1,3-benzodioxol-5-yl)-N-(7-fluoro-2-propyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(3-methyl-1H-indol-4-yl)cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(morpholine-4-carbonyl)-1H-indol-5-yl]cyclopropane-1-carboxamide;N-(2-tert-butyl-6-fluoro-1H-indol-5-yl)-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-hydroxy-3-(2H-tetrazol-5-yl)propyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide;molecular hydrogen
CID 160531284
1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(3-ethoxy-2-hydroxypropyl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-6-fluoro-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]cyclopropane-1-carboxamide;5-[2-[1-(1,3-benzodioxol-5-yl)cyclopropyl]-2-oxoethyl]-2-tert-butyl-1H-indole-3-carbonitrile;1-(1,3-benzodioxol-5-yl)-N-[6-fluoro-2-(1-methylcyclopropyl)-1H-indol-5-yl]cyclopropane-1-carboxamide;2-(1-tert-butylindol-5-yl)-1-[1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropyl]ethanone;molecular hydrogen
CID 160601880
1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(2-methoxyethyl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-6-(trifluoromethyl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[1-[(2S)-2,3-dihydroxypropyl]-6-fluoro-2-(1-methylcyclopropyl)indol-5-yl]cyclopropane-1-carboxamide;1-(2H-benzotriazol-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-(2-tert-butyl-1H-indol-5-yl)-1-(3,4-dihydro-2H-chromen-6-yl)cyclopropane-1-carboxamide;molecular hydrogen
CID 161541412

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide (CID 158635865) is 1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide is CC(C)(C)c1cc2cc(NC(=O)C3(c4ccc5c(c4)OC(F)(F)O5)CC3)ccc2n1CCc1nn[nH]n1.CC(C)(C)c1cc2cc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)ccc2n1C1CCOC1.CC(C)(C)c1cc2cc(NC(=O)C3(c4ccc5ccoc5c4)CC3)ccc2[nH]1.CC(C)(C)c1cc2cc(NC(=O)C3(c4ccc5occc5c4)CC3)ccc2[nH]1.CC(C)(O)c1cc2cc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)ccc2[nH]1.O=C(Nc1ccc2[nH]c(-c3ccccc3)cc2c1)C1(c2ccc3c(c2)OCO3)CC1.
What is the InChIKey of 1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide?
The InChIKey is HZTLZXXBCDBFEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H30N2O4.C26H26F2N6O3.C25H20N2O3.2C24H24N2O2.C22H22N2O4/c1-26(2,3)24-13-17-12-19(5-6-21(17)29(24)20-8-11-31-15-20)28-25(30)27(9-10-27)18-4-7-22-23(14-18)33-16-32-22;1-24(2,3)21-13-15-12-17(5-6-18(15)34(21)11-8-22-30-32-33-31-22)29-23(35)25(9-10-25)16-4-7-19-20(14-16)37-26(27,28)36-19;28-24(25(10-11-25)18-6-9-22-23(14-18)30-15-29-22)26-19-7-8-20-17(12-19)13-21(27-20)16-4-2-1-3-5-16;1-23(2,3)21-14-16-13-18(5-6-19(16)26-21)25-22(27)24(9-10-24)17-4-7-20-15(12-17)8-11-28-20;1-23(2,3)21-13-16-12-18(6-7-19(16)26-21)25-22(27)24(9-10-24)17-5-4-15-8-11-28-20(15)14-17;1-21(2,26)19-10-13-9-15(4-5-16(13)24-19)23-20(25)22(7-8-22)14-3-6-17-18(11-14)28-12-27-17/h4-7,12-14,20H,8-11,15-16H2,1-3H3,(H,28,30);4-7,12-14H,8-11H2,1-3H3,(H,29,35)(H,30,31,32,33);1-9,12-14,27H,10-11,15H2,(H,26,28);2*4-8,11-14,26H,9-10H2,1-3H3,(H,25,27);3-6,9-11,24,26H,7-8,12H2,1-2H3,(H,23,25).
What are the key properties of 1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide?
1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide has a molecular weight of 2474.89 g/mol, XLogP of 30.78, 24 rotatable bonds, 12 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-benzodioxol-5-yl)-N-[2-tert-butyl-1-(oxolan-3-yl)indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-[2-(2-hydroxypropan-2-yl)-1H-indol-5-yl]cyclopropane-1-carboxamide;1-(1,3-benzodioxol-5-yl)-N-(2-phenyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-5-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;1-(1-benzofuran-6-yl)-N-(2-tert-butyl-1H-indol-5-yl)cyclopropane-1-carboxamide;N-[2-tert-butyl-1-[2-(2H-tetrazol-5-yl)ethyl]indol-5-yl]-1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 158635865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).