N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide

C153H120N16O11 — CID 158173207

IUPACN-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide
SMILESC#CCNC(=O)c1ccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)cc1.CCCNC(=O)c1cccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)c1.O=C(NC1CCC(O)CC1)c1ccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)cc1.O=C(Nc1ccccc1)c1cccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)c1.O=C(Nc1cccnc1)c1ccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)cc1
InChIInChI=1S/C32H29N3O3.C32H23N3O2.C31H22N4O2.C29H25N3O2.C29H21N3O2/c36-25-16-14-24(15-17-25)35-32(37)22-12-10-21(11-13-22)29-20-34-31-28(29)18-23(19-33-31)27-8-4-5-9-30(27)38-26-6-2-1-3-7-26;36-32(35-25-12-3-1-4-13-25)23-11-9-10-22(18-23)29-21-34-31-28(29)19-24(20-33-31)27-16-7-8-17-30(27)37-26-14-5-2-6-15-26;36-31(35-24-7-6-16-32-19-24)22-14-12-21(13-15-22)28-20-34-30-27(28)17-23(18-33-30)26-10-4-5-11-29(26)37-25-8-2-1-3-9-25;1-2-15-30-29(33)21-10-8-9-20(16-21)26-19-32-28-25(26)17-22(18-31-28)24-13-6-7-14-27(24)34-23-11-4-3-5-12-23;1-2-16-30-29(33)21-14-12-20(13-15-21)26-19-32-28-25(26)17-22(18-31-28)24-10-6-7-11-27(24)34-23-8-4-3-5-9-23/h1-13,18-20,24-25,36H,14-17H2,(H,33,34)(H,35,37);1-21H,(H,33,34)(H,35,36);1-20H,(H,33,34)(H,35,36);3-14,16-19H,2,15H2,1H3,(H,30,33)(H,31,32);1,3-15,17-19H,16H2,(H,30,33)(H,31,32)
InChIKeyFXRXBWCSNUUVCX-UHFFFAOYSA-N
MW2358.74 g/mol
LogP34.88
Rot. Bonds31

About N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide

N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide (PubChem CID 158173207) has the molecular formula C153H120N16O11 and a molecular weight of 2358.74 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide
PubChem CID158173207
Molecular FormulaC153H120N16O11
Molecular Weight2358.74 g/mol
Exact Mass2356.93
IUPAC NameN-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide
SMILESC#CCNC(=O)c1ccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)cc1.CCCNC(=O)c1cccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)c1.O=C(NC1CCC(O)CC1)c1ccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)cc1.O=C(Nc1ccccc1)c1cccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)c1.O=C(Nc1cccnc1)c1ccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)cc1
InChIInChI=1S/C32H29N3O3.C32H23N3O2.C31H22N4O2.C29H25N3O2.C29H21N3O2/c36-25-16-14-24(15-17-25)35-32(37)22-12-10-21(11-13-22)29-20-34-31-28(29)18-23(19-33-31)27-8-4-5-9-30(27)38-26-6-2-1-3-7-26;36-32(35-25-12-3-1-4-13-25)23-11-9-10-22(18-23)29-21-34-31-28(29)19-24(20-33-31)27-16-7-8-17-30(27)37-26-14-5-2-6-15-26;36-31(35-24-7-6-16-32-19-24)22-14-12-21(13-15-22)28-20-34-30-27(28)17-23(18-33-30)26-10-4-5-11-29(26)37-25-8-2-1-3-9-25;1-2-15-30-29(33)21-10-8-9-20(16-21)26-19-32-28-25(26)17-22(18-31-28)24-13-6-7-14-27(24)34-23-11-4-3-5-12-23;1-2-16-30-29(33)21-14-12-20(13-15-21)26-19-32-28-25(26)17-22(18-31-28)24-10-6-7-11-27(24)34-23-8-4-3-5-9-23/h1-13,18-20,24-25,36H,14-17H2,(H,33,34)(H,35,37);1-21H,(H,33,34)(H,35,36);1-20H,(H,33,34)(H,35,36);3-14,16-19H,2,15H2,1H3,(H,30,33)(H,31,32);1,3-15,17-19H,16H2,(H,30,33)(H,31,32)
InChIKeyFXRXBWCSNUUVCX-UHFFFAOYSA-N
XLogP34.88
TPSA368.17 Ų
H-Bond Donors11
H-Bond Acceptors17
Rotatable Bonds31
Heavy Atoms180
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002358.74
LogP ≤ 534.88
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

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

Analyze N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide with MolForge

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Related Compounds

2-[4-(1,1-difluoroethoxy)phenyl]-1-[4-(6-pyridin-3-yl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]ethanone;2-(4-ethoxyphenyl)-1-[4-(6-pyridin-3-yl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]ethanone;N-(4-methoxyphenyl)-4-(5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide;N-[(4-methylphenyl)methyl]-4-(5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide
CID 158584682
5-[5-fluoro-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]-2-(oxan-4-yloxy)benzonitrile;2-[(3R)-1-(2-hydroxyacetyl)pyrrolidin-3-yl]oxy-5-[2-[4-(2-hydroxypropan-2-yl)phenyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]benzonitrile;2-(oxan-4-yloxy)-5-[2-[4-(2,2,2-trifluoroacetyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]benzonitrile
CID 160501095
4-[3-[(2S)-1-but-2-ynoylpiperidin-2-yl]-8-methylimidazo[1,5-a]pyrazin-1-yl]-N-pyridin-2-ylbenzamide;methane;1-[(2S)-2-[8-methyl-1-[3-[(3-methylphenyl)methoxy]phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]but-2-yn-1-one;4-[8-methyl-3-[(2S)-1-prop-2-enoylpiperidin-2-yl]imidazo[1,5-a]pyrazin-1-yl]-N-pyridin-2-ylbenzamide;4-[5-methyl-3-[(2S)-1-prop-2-enoylpyrrolidin-2-yl]imidazo[1,5-a]pyrazin-1-yl]-N-pyridin-2-ylbenzamide
CID 157077282
3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-5-(2-pyrrolidin-1-ylethoxy)-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)propyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine;tris(1-(4-methylphenyl)-2-[5-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)-2-pyridinyl]ethanone)
CID 157223279
5-[5-(7H-cyclopenta[b]pyridin-3-yl)-6-propan-2-yl-2-pyridinyl]-1H-pyrrolo[2,3-b]pyridine;5-[5-(7H-cyclopenta[b]pyridin-3-yl)-6-propan-2-yl-3-pyridinyl]-1H-pyrrolo[2,3-b]pyridine;6-[6-(3-hydroxy-3-methylbut-1-ynyl)-2-propan-2-yl-3-pyridinyl]-2,3-dihydroinden-1-one;6-[6-(2-methoxy-4-pyridinyl)-2-propan-2-yl-3-pyridinyl]-2,3-dihydroinden-1-one;6-[5-(3-oxo-1,2-dihydroinden-5-yl)-6-propan-2-yl-3-pyridinyl]-2,3-dihydroisoindol-1-one
CID 157253793
N-(cyclopropylmethyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;N-cyclopropyl-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;N-(2-hydroxyethyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;N-(2-methoxyethyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide
CID 157338888
ethyl 4-[2-methyl-6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]benzoate;[3-(3-hydroxyphenyl)-2-methylimidazo[1,2-a]pyridin-6-yl]-piperidin-1-ylmethanone;[3-(4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridin-6-yl]-piperidin-1-ylmethanone;[2-methyl-3-(3-methylphenyl)imidazo[1,2-a]pyridin-6-yl]-piperidin-1-ylmethanone;[2-methyl-3-(4-methylphenyl)imidazo[1,2-a]pyridin-6-yl]-piperidin-1-ylmethanone;N-[3-[2-methyl-6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetamide;[2-methyl-3-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]-piperidin-1-ylmethanone
CID 157368765
N-benzyl-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;N-cyclohexyl-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;N-cyclopropyl-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;N-(2-hydroxyethyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzoic acid;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide
CID 157413435
N,N-dimethyl-4-[3-(1H-1,2,4-triazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]aniline;3-(furan-3-yl)-5-(1H-1,2,4-triazol-5-yl)-1H-pyrrolo[2,3-b]pyridine;N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]furan-2-carboxamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylfuran-2-carboxamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylfuran-2-carboxamide
CID 157427608
N-[3-[3-(2,3-difluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]acetamide;N-[3-[5-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]phenyl]acetamide;N-[4-[5-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]phenyl]acetamide;3-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-methylbenzamide;N-[3-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]acetamide
CID 157554262
2-[2-[4-(2-hydroxypropan-2-yl)phenyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]-5-(oxan-4-yloxy)pyridine-4-carbonitrile;2-[2-[4-(2-methoxypropan-2-yl)phenyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]-5-(oxan-4-yloxy)pyridine-4-carbonitrile;5-[2-(4-methylpiperazine-1-carbonyl)-1H-indol-4-yl]-2-(oxan-4-yloxy)benzonitrile;5-[2-(morpholine-4-carbonyl)-1H-indol-4-yl]-2-(oxan-4-yloxy)benzonitrile;2-(oxan-4-yloxy)-5-[2-(pyrrolidine-1-carbonyl)-1H-indol-4-yl]benzonitrile
CID 157608055
2-[2-[4-(2-hydroxypropan-2-yl)phenyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]-5-(oxan-4-yloxy)pyridine-4-carbonitrile;2-[2-[4-(2-methoxypropan-2-yl)phenyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]-5-(oxan-4-yloxy)pyridine-4-carbonitrile;5-[2-(4-methylpiperazine-1-carbonyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]-2-(oxan-4-yloxy)benzonitrile;5-[2-(morpholine-4-carbonyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]-2-(oxan-4-yloxy)benzonitrile;2-(oxan-4-yloxy)-5-[2-(pyrrolidine-1-carbonyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]benzonitrile
CID 157688306

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide (CID 158173207) is N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide is C#CCNC(=O)c1ccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)cc1.CCCNC(=O)c1cccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)c1.O=C(NC1CCC(O)CC1)c1ccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)cc1.O=C(Nc1ccccc1)c1cccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)c1.O=C(Nc1cccnc1)c1ccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)cc1.
What is the InChIKey of N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide?
The InChIKey is FXRXBWCSNUUVCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H29N3O3.C32H23N3O2.C31H22N4O2.C29H25N3O2.C29H21N3O2/c36-25-16-14-24(15-17-25)35-32(37)22-12-10-21(11-13-22)29-20-34-31-28(29)18-23(19-33-31)27-8-4-5-9-30(27)38-26-6-2-1-3-7-26;36-32(35-25-12-3-1-4-13-25)23-11-9-10-22(18-23)29-21-34-31-28(29)19-24(20-33-31)27-16-7-8-17-30(27)37-26-14-5-2-6-15-26;36-31(35-24-7-6-16-32-19-24)22-14-12-21(13-15-22)28-20-34-30-27(28)17-23(18-33-30)26-10-4-5-11-29(26)37-25-8-2-1-3-9-25;1-2-15-30-29(33)21-10-8-9-20(16-21)26-19-32-28-25(26)17-22(18-31-28)24-13-6-7-14-27(24)34-23-11-4-3-5-12-23;1-2-16-30-29(33)21-14-12-20(13-15-21)26-19-32-28-25(26)17-22(18-31-28)24-10-6-7-11-27(24)34-23-8-4-3-5-9-23/h1-13,18-20,24-25,36H,14-17H2,(H,33,34)(H,35,37);1-21H,(H,33,34)(H,35,36);1-20H,(H,33,34)(H,35,36);3-14,16-19H,2,15H2,1H3,(H,30,33)(H,31,32);1,3-15,17-19H,16H2,(H,30,33)(H,31,32).
What are the key properties of N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide?
N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide has a molecular weight of 2358.74 g/mol, XLogP of 34.88, 31 rotatable bonds, 11 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]benzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide;3-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-propylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-prop-2-ynylbenzamide;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 158173207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).