4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol

C124H143N5O10 — CID 158902462

IUPAC4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol
SMILESCc1ccc(/C(=C(\CCCO)c2ccccc2)c2ccc(N3CCCCC3)cc2)cc1.OCCC/C(=C(\c1ccc(O)cc1)c1ccc(OCCN2CC3CC3C2)cc1)c1ccccc1.OCCC/C(=C(\c1ccc(O)cc1)c1ccc(OCCN2CCC3(CCCC3)C2)cc1)c1ccccc1.OCCC/C(=C(\c1ccc(O)cc1)c1ccc(OCCN2CCC3(CCNC3)C2)cc1)c1ccccc1
InChIInChI=1S/C33H39NO3.C32H38N2O3.C30H33NO3.C29H33NO/c35-23-6-9-31(26-7-2-1-3-8-26)32(27-10-14-29(36)15-11-27)28-12-16-30(17-13-28)37-24-22-34-21-20-33(25-34)18-4-5-19-33;35-21-4-7-30(25-5-2-1-3-6-25)31(26-8-12-28(36)13-9-26)27-10-14-29(15-11-27)37-22-20-34-19-17-32(24-34)16-18-33-23-32;32-17-4-7-29(22-5-2-1-3-6-22)30(23-8-12-27(33)13-9-23)24-10-14-28(15-11-24)34-18-16-31-20-25-19-26(25)21-31;1-23-12-14-25(15-13-23)29(28(11-8-22-31)24-9-4-2-5-10-24)26-16-18-27(19-17-26)30-20-6-3-7-21-30/h1-3,7-8,10-17,35-36H,4-6,9,18-25H2;1-3,5-6,8-15,33,35-36H,4,7,16-24H2;1-3,5-6,8-15,25-26,32-33H,4,7,16-21H2;2,4-5,9-10,12-19,31H,3,6-8,11,20-22H2,1H3/b32-31-;31-30-;30-29-;29-28-
InChIKeyJFPSGXLVMVBTLX-SYJCRNSWSA-N
MW1863.53 g/mol
LogP24.13
Rot. Bonds37

About 4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol

4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol (PubChem CID 158902462) has the molecular formula C124H143N5O10 and a molecular weight of 1863.53 g/mol. Its IUPAC name is 4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol.

Molecular Properties

Compound Name4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol
PubChem CID158902462
Molecular FormulaC124H143N5O10
Molecular Weight1863.53 g/mol
Exact Mass1862.08
IUPAC Name4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol
SMILESCc1ccc(/C(=C(\CCCO)c2ccccc2)c2ccc(N3CCCCC3)cc2)cc1.OCCC/C(=C(\c1ccc(O)cc1)c1ccc(OCCN2CC3CC3C2)cc1)c1ccccc1.OCCC/C(=C(\c1ccc(O)cc1)c1ccc(OCCN2CCC3(CCCC3)C2)cc1)c1ccccc1.OCCC/C(=C(\c1ccc(O)cc1)c1ccc(OCCN2CCC3(CCNC3)C2)cc1)c1ccccc1
InChIInChI=1S/C33H39NO3.C32H38N2O3.C30H33NO3.C29H33NO/c35-23-6-9-31(26-7-2-1-3-8-26)32(27-10-14-29(36)15-11-27)28-12-16-30(17-13-28)37-24-22-34-21-20-33(25-34)18-4-5-19-33;35-21-4-7-30(25-5-2-1-3-6-25)31(26-8-12-28(36)13-9-26)27-10-14-29(15-11-27)37-22-20-34-19-17-32(24-34)16-18-33-23-32;32-17-4-7-29(22-5-2-1-3-6-22)30(23-8-12-27(33)13-9-23)24-10-14-28(15-11-24)34-18-16-31-20-25-19-26(25)21-31;1-23-12-14-25(15-13-23)29(28(11-8-22-31)24-9-4-2-5-10-24)26-16-18-27(19-17-26)30-20-6-3-7-21-30/h1-3,7-8,10-17,35-36H,4-6,9,18-25H2;1-3,5-6,8-15,33,35-36H,4,7,16-24H2;1-3,5-6,8-15,25-26,32-33H,4,7,16-21H2;2,4-5,9-10,12-19,31H,3,6-8,11,20-22H2,1H3/b32-31-;31-30-;30-29-;29-28-
InChIKeyJFPSGXLVMVBTLX-SYJCRNSWSA-N
XLogP24.13
TPSA194.29 Ų
H-Bond Donors8
H-Bond Acceptors15
Rotatable Bonds37
Heavy Atoms139
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001863.53
LogP ≤ 524.13
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_B(251)', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol with MolForge

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Related Compounds

N-cyclobutyl-4-propan-2-ylaniline;N-cyclohexyl-4-propan-2-ylaniline;1-cyclopentyloxy-4-propan-2-ylbenzene;4,4-difluoro-1-[(4-propan-2-ylphenyl)methyl]piperidine;3,3-difluoro-1-[(4-propan-2-ylphenyl)methyl]pyrrolidine;N,N-dimethyl-4-propan-2-ylaniline;N-ethyl-2-methyl-N-[(4-propan-2-ylphenyl)methyl]oxolan-3-amine;3-ethyl-1-(4-propan-2-ylphenyl)pentan-3-ol;N-(oxolan-3-ylmethyl)-4-propan-2-ylaniline
CID 157939070
N-cyclobutyl-4-propan-2-ylaniline;N-cyclohexyl-4-propan-2-ylaniline;1-cyclopentyloxy-4-propan-2-ylbenzene;4,4-difluoro-1-[(4-propan-2-ylphenyl)methyl]piperidine;3,3-difluoro-1-[(4-propan-2-ylphenyl)methyl]pyrrolidine;N,N-dimethyl-4-propan-2-ylaniline;N-ethyl-2-methyl-N-[(4-propan-2-ylphenyl)methyl]oxolan-3-amine;3-ethyl-1-(4-propan-2-ylphenyl)pentan-3-ol;2-methyl-N-(4-propan-2-ylphenyl)oxolan-3-amine;N-(oxolan-3-ylmethyl)-4-propan-2-ylaniline;1-[(4-propan-2-ylphenyl)methyl]-2-(trifluoromethyl)pyrrolidine
CID 158018354
N-cyclobutyl-4-propan-2-ylaniline;1-cyclopentyloxy-4-propan-2-ylbenzene;4,4-difluoro-1-[(4-propan-2-ylphenyl)methyl]piperidine;3,3-difluoro-1-[(4-propan-2-ylphenyl)methyl]pyrrolidine;N,N-dimethyl-4-propan-2-ylaniline;N-ethyl-2-methyl-N-[(4-propan-2-ylphenyl)methyl]oxolan-3-amine;3-ethyl-1-(4-propan-2-ylphenyl)pentan-3-ol;2-methyl-N-(4-propan-2-ylphenyl)oxolan-3-amine;N-(oxolan-3-ylmethyl)-4-propan-2-ylaniline;1-[(4-propan-2-ylphenyl)methyl]-2-(trifluoromethyl)pyrrolidine
CID 158951320
N-cyclobutyl-4-propan-2-ylaniline;N-cyclohexyl-4-propan-2-ylaniline;1-cyclopentyloxy-4-propan-2-ylbenzene;4,4-difluoro-1-[(4-propan-2-ylphenyl)methyl]piperidine;3,3-difluoro-1-[(4-propan-2-ylphenyl)methyl]pyrrolidine;N,N-dimethyl-4-propan-2-ylaniline;N-ethyl-2-methyl-N-[(4-propan-2-ylphenyl)methyl]oxolan-3-amine;3-ethyl-1-(4-propan-2-ylphenyl)pentan-3-ol;N-(oxolan-3-ylmethyl)-4-propan-2-ylaniline;1-[(4-propan-2-ylphenyl)methyl]-2-(trifluoromethyl)pyrrolidine
CID 162159230
(Z)-5-(4-aminophenyl)-5-[4-(4-methylpiperazin-1-yl)phenyl]-4-phenylpent-4-en-1-ol;4-[(E)-1-(4-cyclohexylphenyl)-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(E)-1-[4-(1-cyclopropylazetidin-3-yl)phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-[4-[3-(dimethylamino)cyclobutyl]phenyl]-5-(4-methylphenyl)-4-phenylpent-4-en-1-ol;(Z)-5-(4-methylphenyl)-5-[4-(4-methylpiperazin-1-yl)phenyl]-4-phenylpent-4-en-1-ol;(Z)-5-(4-methylphenyl)-4-phenyl-5-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]pent-4-en-1-ol;(E)-5-[4-(4-methylpiperazin-1-yl)phenyl]-5-(4-nitrophenyl)-4-phenylpent-4-en-1-ol
CID 157272572
1-[2-(4-tert-butylphenoxy)ethyl]pyrrolidine;1-(4-tert-butylphenyl)-4-cyclopropylpiperazine;1-[2-(4-tert-butylphenyl)ethyl]pyrrolidine;N-[(4-tert-butylphenyl)methyl]cyclohexanamine;1-[(3-tert-butylphenyl)methyl]-4-methylpiperazine;1-(3-tert-butylphenyl)-4-methylpiperazine;1-[(4-tert-butylphenyl)methyl]pyrrolidine;4-(4-tert-butylphenyl)morpholine
CID 157510917
4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(E)-1-(4-cyclohexylphenyl)-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(E)-5-hydroxy-2-phenyl-1-[4-(1-prop-1-en-2-ylpiperidin-4-yl)phenyl]pent-1-enyl]phenol
CID 157637192
4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-5-hydroxy-2-phenyl-1-[4-(2-piperazin-1-ylethoxy)phenyl]pent-1-enyl]phenol
CID 159255901
(Z)-5-(4-cyclobutylphenyl)-5-(4-methylphenyl)-4-phenylpent-4-en-1-ol;4-[(Z)-5-hydroxy-1-[4-[2-[(1R,2S,5S)-2-(hydroxymethyl)-3-azabicyclo[3.1.0]hexan-3-yl]ethoxy]phenyl]-2-phenylpent-1-enyl]phenol;4-[(Z)-5-hydroxy-1-[4-[2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]ethoxy]phenyl]-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol
CID 160239550
2-[(3aS,6aR)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-N-[4-[(E)-5-hydroxy-1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenyl]acetamide;4-[(Z)-5-hydroxy-1-[4-[2-[(1R,2S,5S)-2-(hydroxymethyl)-3-azabicyclo[3.1.0]hexan-3-yl]ethoxy]phenyl]-2-phenylpent-1-enyl]phenol;4-[(Z)-5-hydroxy-1-[4-[2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]ethoxy]phenyl]-2-phenylpent-1-enyl]phenol
CID 160311245
3-[4-(2,2-dimethylpropyl)phenoxy]pyrrolidine;4-[4-(2,2-dimethylpropyl)phenyl]-1-methyl-3,6-dihydro-2H-pyridine;2-[4-(2,2-dimethylpropyl)phenyl]-4-methylmorpholine;N-[4-(2,2-dimethylpropyl)phenyl]-1-methylpiperidin-4-amine;3-[4-(2,2-dimethylpropyl)phenyl]-1-methylpiperidine;4-[4-(2,2-dimethylpropyl)phenyl]-1-methylpiperidine;N-[4-(2,2-dimethylpropyl)phenyl]-1-methylpyrrolidin-3-amine;3-[4-(2,2-dimethylpropyl)phenyl]-1-methylpyrrolidine;3-[4-(2,2-dimethylpropyl)phenyl]piperidine;4-[4-(2,2-dimethylpropyl)phenyl]-1,2,3,6-tetrahydropyridine;methane
CID 160459396
4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol
CID 160738895

Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol?
The IUPAC name of 4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol (CID 158902462) is 4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol.
What is the SMILES notation for 4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol?
The canonical SMILES for 4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol is Cc1ccc(/C(=C(\CCCO)c2ccccc2)c2ccc(N3CCCCC3)cc2)cc1.OCCC/C(=C(\c1ccc(O)cc1)c1ccc(OCCN2CC3CC3C2)cc1)c1ccccc1.OCCC/C(=C(\c1ccc(O)cc1)c1ccc(OCCN2CCC3(CCCC3)C2)cc1)c1ccccc1.OCCC/C(=C(\c1ccc(O)cc1)c1ccc(OCCN2CCC3(CCNC3)C2)cc1)c1ccccc1.
What is the InChIKey of 4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol?
The InChIKey is JFPSGXLVMVBTLX-SYJCRNSWSA-N. The full InChI is InChI=1S/C33H39NO3.C32H38N2O3.C30H33NO3.C29H33NO/c35-23-6-9-31(26-7-2-1-3-8-26)32(27-10-14-29(36)15-11-27)28-12-16-30(17-13-28)37-24-22-34-21-20-33(25-34)18-4-5-19-33;35-21-4-7-30(25-5-2-1-3-6-25)31(26-8-12-28(36)13-9-26)27-10-14-29(15-11-27)37-22-20-34-19-17-32(24-34)16-18-33-23-32;32-17-4-7-29(22-5-2-1-3-6-22)30(23-8-12-27(33)13-9-23)24-10-14-28(15-11-24)34-18-16-31-20-25-19-26(25)21-31;1-23-12-14-25(15-13-23)29(28(11-8-22-31)24-9-4-2-5-10-24)26-16-18-27(19-17-26)30-20-6-3-7-21-30/h1-3,7-8,10-17,35-36H,4-6,9,18-25H2;1-3,5-6,8-15,33,35-36H,4,7,16-24H2;1-3,5-6,8-15,25-26,32-33H,4,7,16-21H2;2,4-5,9-10,12-19,31H,3,6-8,11,20-22H2,1H3/b32-31-;31-30-;30-29-;29-28-.
What are the key properties of 4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol?
4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol has a molecular weight of 1863.53 g/mol, XLogP of 24.13, 37 rotatable bonds, 8 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-1-[4-[2-(3-azabicyclo[3.1.0]hexan-3-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2-azaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;4-[(Z)-1-[4-[2-(2,7-diazaspiro[4.4]nonan-2-yl)ethoxy]phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol;(Z)-5-(4-methylphenyl)-4-phenyl-5-(4-piperidin-1-ylphenyl)pent-4-en-1-ol is sourced from PubChem (CID 158902462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).