N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide

C169H169N29O13 — CID 160674326

IUPACN-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide
SMILESO=C(NC12CC3CC(CC(C3)C1)C2)c1ccc2nc(-c3ccc(NC(=O)c4ccccn4)cc3)[nH]c2c1.O=C(NC1CCCC1OCc1ccccc1)c1ccc2nc(-c3ccc(NC(=O)C4CCCCCC4)cc3)[nH]c2c1.O=C(NC1CCCCC1)c1ccc2nc(-c3ccc(NC(=O)c4ccccn4)cc3)[nH]c2c1.O=C(Nc1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1)c1cccnc1.O=C(Nc1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1)c1ccncc1.O=C(Nc1ccc(-c2nc3ccc(C(=O)NC4CCCCCC4)cc3[nH]2)cc1)c1cccnc1
InChIInChI=1S/C34H38N4O3.C30H29N5O2.C27H27N5O2.3C26H25N5O2/c39-33(25-11-6-1-2-7-12-25)35-27-18-15-24(16-19-27)32-36-28-20-17-26(21-30(28)37-32)34(40)38-29-13-8-14-31(29)41-22-23-9-4-3-5-10-23;36-28(35-30-15-18-11-19(16-30)13-20(12-18)17-30)22-6-9-24-26(14-22)34-27(33-24)21-4-7-23(8-5-21)32-29(37)25-3-1-2-10-31-25;33-26(29-21-7-3-1-2-4-8-21)19-11-14-23-24(16-19)32-25(31-23)18-9-12-22(13-10-18)30-27(34)20-6-5-15-28-17-20;32-25(28-20-6-2-1-3-7-20)18-10-13-22-23(15-18)31-24(30-22)17-8-11-21(12-9-17)29-26(33)19-5-4-14-27-16-19;32-25(28-19-6-2-1-3-7-19)18-11-14-21-23(16-18)31-24(30-21)17-9-12-20(13-10-17)29-26(33)22-8-4-5-15-27-22;32-25(18-12-14-27-15-13-18)29-21-9-6-17(7-10-21)24-30-22-11-8-19(16-23(22)31-24)26(33)28-20-4-2-1-3-5-20/h3-5,9-10,15-21,25,29,31H,1-2,6-8,11-14,22H2,(H,35,39)(H,36,37)(H,38,40);1-10,14,18-20H,11-13,15-17H2,(H,32,37)(H,33,34)(H,35,36);5-6,9-17,21H,1-4,7-8H2,(H,29,33)(H,30,34)(H,31,32);4-5,8-16,20H,1-3,6-7H2,(H,28,32)(H,29,33)(H,30,31);4-5,8-16,19H,1-3,6-7H2,(H,28,32)(H,29,33)(H,30,31);6-16,20H,1-5H2,(H,28,33)(H,29,32)(H,30,31)
InChIKeyRNILHWKBFCITCI-UHFFFAOYSA-N
MW2814.40 g/mol
LogP32.73
Rot. Bonds33

About N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide

N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide (PubChem CID 160674326) has the molecular formula C169H169N29O13 and a molecular weight of 2814.40 g/mol. Its IUPAC name is N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide.

Molecular Properties

Compound NameN-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide
PubChem CID160674326
Molecular FormulaC169H169N29O13
Molecular Weight2814.40 g/mol
Exact Mass2812.35
IUPAC NameN-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide
SMILESO=C(NC12CC3CC(CC(C3)C1)C2)c1ccc2nc(-c3ccc(NC(=O)c4ccccn4)cc3)[nH]c2c1.O=C(NC1CCCC1OCc1ccccc1)c1ccc2nc(-c3ccc(NC(=O)C4CCCCCC4)cc3)[nH]c2c1.O=C(NC1CCCCC1)c1ccc2nc(-c3ccc(NC(=O)c4ccccn4)cc3)[nH]c2c1.O=C(Nc1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1)c1cccnc1.O=C(Nc1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1)c1ccncc1.O=C(Nc1ccc(-c2nc3ccc(C(=O)NC4CCCCCC4)cc3[nH]2)cc1)c1cccnc1
InChIInChI=1S/C34H38N4O3.C30H29N5O2.C27H27N5O2.3C26H25N5O2/c39-33(25-11-6-1-2-7-12-25)35-27-18-15-24(16-19-27)32-36-28-20-17-26(21-30(28)37-32)34(40)38-29-13-8-14-31(29)41-22-23-9-4-3-5-10-23;36-28(35-30-15-18-11-19(16-30)13-20(12-18)17-30)22-6-9-24-26(14-22)34-27(33-24)21-4-7-23(8-5-21)32-29(37)25-3-1-2-10-31-25;33-26(29-21-7-3-1-2-4-8-21)19-11-14-23-24(16-19)32-25(31-23)18-9-12-22(13-10-18)30-27(34)20-6-5-15-28-17-20;32-25(28-20-6-2-1-3-7-20)18-10-13-22-23(15-18)31-24(30-22)17-8-11-21(12-9-17)29-26(33)19-5-4-14-27-16-19;32-25(28-19-6-2-1-3-7-19)18-11-14-21-23(16-18)31-24(30-21)17-9-12-20(13-10-17)29-26(33)22-8-4-5-15-27-22;32-25(18-12-14-27-15-13-18)29-21-9-6-17(7-10-21)24-30-22-11-8-19(16-23(22)31-24)26(33)28-20-4-2-1-3-5-20/h3-5,9-10,15-21,25,29,31H,1-2,6-8,11-14,22H2,(H,35,39)(H,36,37)(H,38,40);1-10,14,18-20H,11-13,15-17H2,(H,32,37)(H,33,34)(H,35,36);5-6,9-17,21H,1-4,7-8H2,(H,29,33)(H,30,34)(H,31,32);4-5,8-16,20H,1-3,6-7H2,(H,28,32)(H,29,33)(H,30,31);4-5,8-16,19H,1-3,6-7H2,(H,28,32)(H,29,33)(H,30,31);6-16,20H,1-5H2,(H,28,33)(H,29,32)(H,30,31)
InChIKeyRNILHWKBFCITCI-UHFFFAOYSA-N
XLogP32.73
TPSA594.96 Ų
H-Bond Donors18
H-Bond Acceptors24
Rotatable Bonds33
Heavy Atoms211
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002814.40
LogP ≤ 532.73
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1024

Analyze N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide with MolForge

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Related Compounds

N-[[4-[5-(3H-benzimidazol-5-yl)-1,2,4-oxadiazol-3-yl]phenyl]methyl]-N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentylbenzamide;N-[[4-(5-benzyl-1,2,4-oxadiazol-3-yl)phenyl]methyl]-N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentylbenzamide;N-[1-(3-methylbutyl)piperidin-4-yl]-N-[[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]methyl]-4-pentylbenzamide;N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentyl-N-[[4-(5-pentyl-1,2,4-oxadiazol-3-yl)phenyl]methyl]benzamide;N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentyl-N-[[4-(5-phenyl-1,2,4-oxadiazol-3-yl)phenyl]methyl]benzamide;N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentyl-N-[[4-(5-pyridin-3-yl-1,2,4-oxadiazol-3-yl)phenyl]methyl]benzamide;N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentyl-N-[[4-[5-(3,3,3-trifluoropropyl)-1,2,4-oxadiazol-3-yl]phenyl]methyl]benzamide
CID 159813237
2-[4-(adamantane-1-carbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;2-[4-(adamantane-1-carbonylamino)phenyl]-N-pyridin-3-yl-3H-benzimidazole-5-carboxamide;1-adamantyl-oxo-[4-[6-(pyridin-4-ylcarbamoyl)-1H-benzimidazol-2-yl]phenyl]azanium;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexanecarbonylamino)phenyl]-N-pyridin-3-yl-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexanecarbonylamino)phenyl]-N-pyridin-4-yl-3H-benzimidazole-5-carboxamide
CID 157118854
N,N-dimethyl-1-(6-oxo-7,8-dihydro-5H-1,5-naphthyridin-2-yl)-2-propan-2-ylbenzimidazole-5-carboxamide;N-methyl-2-(morpholine-4-carbonyl)-1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)benzimidazole-5-carboxamide;N-methyl-1-(6-oxo-7,8-dihydro-5H-1,5-naphthyridin-2-yl)-2-propan-2-ylbenzimidazole-5-carboxamide;N-methyl-1-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-3-yl)-2-propan-2-ylbenzimidazole-5-carboxamide;methyl 1-(6-oxo-7,8-dihydro-5H-1,5-naphthyridin-2-yl)-2-propan-2-ylbenzimidazole-5-carboxylate
CID 157262141
N-[4-[2-[2-(dimethylamino)ethoxy]propan-2-yl]-2-(4-methylpiperidin-1-yl)phenyl]-5-isocyano-1H-imidazole-2-carboxamide;N-[4-[2-[2-(dimethylamino)ethoxy]propan-2-yl]-2-(4-methylpiperidin-1-yl)phenyl]-4-isocyano-1H-pyrrole-2-carboxamide;N-[4-[1-(dimethylamino)ethyl]-2-spiro[4.5]dec-8-en-8-ylphenyl]-5-isocyano-1H-imidazole-2-carboxamide;N-[2-(4,4-dimethylcyclohexen-1-yl)-4-[1-(2-imidazol-1-ylethoxy)propyl]phenyl]-5-isocyano-1H-imidazole-2-carboxamide;N-[4-[1-(4-ethylpiperazin-1-yl)ethyl]-2-spiro[4.5]dec-8-en-8-ylphenyl]-5-isocyano-1H-imidazole-2-carboxamide
CID 157439144
2-[4-(adamantane-1-carbonylamino)phenyl]-N-pyridin-3-yl-3H-benzimidazole-5-carboxamide;2-[4-(adamantane-1-carbonylamino)phenyl]-N-pyridin-4-yl-3H-benzimidazole-5-carboxamide;N-(1-adamantyl)-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexanecarbonylamino)phenyl]-N-pyridin-3-yl-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexanecarbonylamino)phenyl]-N-pyridin-4-yl-3H-benzimidazole-5-carboxamide
CID 157527886
5-amino-N-(furan-2-ylmethyl)-6-(6-methyl-1H-benzimidazol-2-yl)pyrazine-2-carboxamide;5-amino-N-(2-hydroxypropyl)-6-(6-methyl-1H-benzimidazol-2-yl)pyrazine-2-carboxamide;5-amino-N-[(4-methoxyphenyl)methyl]-6-(6-methyl-1H-benzimidazol-2-yl)pyrazine-2-carboxamide;5-amino-6-(6-methyl-1H-benzimidazol-2-yl)-N-(2-phenylethyl)pyrazine-2-carboxamide;5-amino-6-(6-methyl-1H-benzimidazol-2-yl)-N-prop-2-enylpyrazine-2-carboxamide;molecular hydrogen
CID 158028360
1-[4-[5-[(dimethylamino)methyl]-1,3-oxazol-2-yl]-6-[1-(2-methylpropyl)-2-oxo-4-pyridinyl]-1H-benzimidazol-2-yl]-3-ethylurea;1-[6-[6-[1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]-3-pyridinyl]-4-pyridin-2-yl-1H-benzimidazol-2-yl]-3-ethylurea;ethyl N-[6-[5-(2-morpholin-4-ylethylcarbamoyl)-3-pyridinyl]-4-pyridin-2-yl-1H-benzimidazol-2-yl]carbamate;1-ethyl-3-[6-[6-(1-morpholin-4-ylethyl)-3-pyridinyl]-4-pyridin-2-yl-1H-benzimidazol-2-yl]urea
CID 158296669
2-[4-(adamantane-1-carbonylamino)phenyl]-N-pyridin-3-yl-3H-benzimidazole-5-carboxamide;N-(1-adamantyl)-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-(1-adamantyl)-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cyclohexanecarbonylamino)phenyl]-N-pyridin-3-yl-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide
CID 159233503
N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-(1-adamantyl)-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-(1-adamantyl)-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide
CID 159354014
N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-(1-adamantyl)-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-(1-adamantyl)-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide
CID 159377033
5-amino-N-(2-amino-2-oxoethyl)-6-(6-methyl-1H-benzimidazol-2-yl)pyrazine-2-carboxamide;5-amino-N-(cyclopentylmethyl)-6-(6-methyl-1H-benzimidazol-2-yl)pyrazine-2-carboxamide;5-amino-6-(6-methyl-1H-benzimidazol-2-yl)-N-(oxolan-2-ylmethyl)pyrazine-2-carboxamide;[5-amino-6-(6-methyl-1H-benzimidazol-2-yl)pyrazin-2-yl]-morpholin-4-ylmethanone;5-amino-6-(6-methyl-1H-benzimidazol-2-yl)-N-(2-pyrrolidin-1-ylethyl)pyrazine-2-carboxamide;molecular hydrogen
CID 159647198
3-[2-(7-benzyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-1H-indole;ethyl 3-[2-(7-ethyl-7-methyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-1H-indole-2-carboxylate;2-[2-(7-ethyl-7-methyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-1H-benzimidazole;2-[2-(7-ethyl-7-methyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-1H-indole;3-[3-(7-ethyl-7-methyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)propyl]-1H-indole;3-[2-(7-methyl-7-propyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-1H-indole
CID 159765000

Frequently Asked Questions

What is the IUPAC name of N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide?
The IUPAC name of N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide (CID 160674326) is N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide.
What is the SMILES notation for N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide?
The canonical SMILES for N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide is O=C(NC12CC3CC(CC(C3)C1)C2)c1ccc2nc(-c3ccc(NC(=O)c4ccccn4)cc3)[nH]c2c1.O=C(NC1CCCC1OCc1ccccc1)c1ccc2nc(-c3ccc(NC(=O)C4CCCCCC4)cc3)[nH]c2c1.O=C(NC1CCCCC1)c1ccc2nc(-c3ccc(NC(=O)c4ccccn4)cc3)[nH]c2c1.O=C(Nc1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1)c1cccnc1.O=C(Nc1ccc(-c2nc3ccc(C(=O)NC4CCCCC4)cc3[nH]2)cc1)c1ccncc1.O=C(Nc1ccc(-c2nc3ccc(C(=O)NC4CCCCCC4)cc3[nH]2)cc1)c1cccnc1.
What is the InChIKey of N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide?
The InChIKey is RNILHWKBFCITCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H38N4O3.C30H29N5O2.C27H27N5O2.3C26H25N5O2/c39-33(25-11-6-1-2-7-12-25)35-27-18-15-24(16-19-27)32-36-28-20-17-26(21-30(28)37-32)34(40)38-29-13-8-14-31(29)41-22-23-9-4-3-5-10-23;36-28(35-30-15-18-11-19(16-30)13-20(12-18)17-30)22-6-9-24-26(14-22)34-27(33-24)21-4-7-23(8-5-21)32-29(37)25-3-1-2-10-31-25;33-26(29-21-7-3-1-2-4-8-21)19-11-14-23-24(16-19)32-25(31-23)18-9-12-22(13-10-18)30-27(34)20-6-5-15-28-17-20;32-25(28-20-6-2-1-3-7-20)18-10-13-22-23(15-18)31-24(30-22)17-8-11-21(12-9-17)29-26(33)19-5-4-14-27-16-19;32-25(28-19-6-2-1-3-7-19)18-11-14-21-23(16-18)31-24(30-21)17-9-12-20(13-10-17)29-26(33)22-8-4-5-15-27-22;32-25(18-12-14-27-15-13-18)29-21-9-6-17(7-10-21)24-30-22-11-8-19(16-23(22)31-24)26(33)28-20-4-2-1-3-5-20/h3-5,9-10,15-21,25,29,31H,1-2,6-8,11-14,22H2,(H,35,39)(H,36,37)(H,38,40);1-10,14,18-20H,11-13,15-17H2,(H,32,37)(H,33,34)(H,35,36);5-6,9-17,21H,1-4,7-8H2,(H,29,33)(H,30,34)(H,31,32);4-5,8-16,20H,1-3,6-7H2,(H,28,32)(H,29,33)(H,30,31);4-5,8-16,19H,1-3,6-7H2,(H,28,32)(H,29,33)(H,30,31);6-16,20H,1-5H2,(H,28,33)(H,29,32)(H,30,31).
What are the key properties of N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide?
N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide has a molecular weight of 2814.40 g/mol, XLogP of 32.73, 33 rotatable bonds, 18 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantyl)-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;2-[4-(cycloheptanecarbonylamino)phenyl]-N-(2-phenylmethoxycyclopentyl)-3H-benzimidazole-5-carboxamide;N-cycloheptyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-2-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-3-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide;N-cyclohexyl-2-[4-(pyridine-4-carbonylamino)phenyl]-3H-benzimidazole-5-carboxamide is sourced from PubChem (CID 160674326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).