(2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol

C170H217N15O14 — CID 160974738

IUPAC(2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol
SMILESCC(C)n1ccc(-c2ccc(OCC(O)CN3CCc4ccccc4C3)cc2)n1.CC(C)n1nccc1-c1ccc(OCC(O)CN2CCc3ccccc3C2)cc1.CN(Cc1ccc(OCC(O)CN2CCc3ccccc3C2)cc1)C1CCCC1.Cc1nn(-c2ccccc2)c(C)c1COCC(O)CN1CCc2ccccc2C1.OC(COc1ccc(C2CCNCC2)cc1)CN1CCc2ccccc2C1.O[C@@H](COc1cccc(CCC2CCCC2)c1)CN1CCc2ccccc2C1.O[C@H](COc1cccc(CCC2CCCC2)c1)CN1CCc2ccccc2C1
InChIInChI=1S/C25H34N2O2.2C25H33NO2.3C24H29N3O2.C23H30N2O2/c1-26(23-8-4-5-9-23)16-20-10-12-25(13-11-20)29-19-24(28)18-27-15-14-21-6-2-3-7-22(21)17-27;2*27-24(18-26-15-14-22-9-3-4-10-23(22)17-26)19-28-25-11-5-8-21(16-25)13-12-20-6-1-2-7-20;1-18-24(19(2)27(25-18)22-10-4-3-5-11-22)17-29-16-23(28)15-26-13-12-20-8-6-7-9-21(20)14-26;1-18(2)27-24(11-13-25-27)20-7-9-23(10-8-20)29-17-22(28)16-26-14-12-19-5-3-4-6-21(19)15-26;1-18(2)27-14-12-24(25-27)20-7-9-23(10-8-20)29-17-22(28)16-26-13-11-19-5-3-4-6-21(19)15-26;26-22(16-25-14-11-18-3-1-2-4-21(18)15-25)17-27-23-7-5-19(6-8-23)20-9-12-24-13-10-20/h2-3,6-7,10-13,23-24,28H,4-5,8-9,14-19H2,1H3;2*3-5,8-11,16,20,24,27H,1-2,6-7,12-15,17-19H2;3-11,23,28H,12-17H2,1-2H3;3-11,13,18,22,28H,12,14-17H2,1-2H3;3-10,12,14,18,22,28H,11,13,15-17H2,1-2H3;1-8,20,22,24,26H,9-17H2/t;2*24-;;;;/m.10..../s1
InChIKeySYSCFKSDRNJKDO-LUNNQFHKSA-N
MW2694.70 g/mol
LogP27.31
Rot. Bonds51

About (2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol

(2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol (PubChem CID 160974738) has the molecular formula C170H217N15O14 and a molecular weight of 2694.70 g/mol. Its IUPAC name is (2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol
PubChem CID160974738
Molecular FormulaC170H217N15O14
Molecular Weight2694.70 g/mol
Exact Mass2692.67
IUPAC Name(2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol
SMILESCC(C)n1ccc(-c2ccc(OCC(O)CN3CCc4ccccc4C3)cc2)n1.CC(C)n1nccc1-c1ccc(OCC(O)CN2CCc3ccccc3C2)cc1.CN(Cc1ccc(OCC(O)CN2CCc3ccccc3C2)cc1)C1CCCC1.Cc1nn(-c2ccccc2)c(C)c1COCC(O)CN1CCc2ccccc2C1.OC(COc1ccc(C2CCNCC2)cc1)CN1CCc2ccccc2C1.O[C@@H](COc1cccc(CCC2CCCC2)c1)CN1CCc2ccccc2C1.O[C@H](COc1cccc(CCC2CCCC2)c1)CN1CCc2ccccc2C1
InChIInChI=1S/C25H34N2O2.2C25H33NO2.3C24H29N3O2.C23H30N2O2/c1-26(23-8-4-5-9-23)16-20-10-12-25(13-11-20)29-19-24(28)18-27-15-14-21-6-2-3-7-22(21)17-27;2*27-24(18-26-15-14-22-9-3-4-10-23(22)17-26)19-28-25-11-5-8-21(16-25)13-12-20-6-1-2-7-20;1-18-24(19(2)27(25-18)22-10-4-3-5-11-22)17-29-16-23(28)15-26-13-12-20-8-6-7-9-21(20)14-26;1-18(2)27-24(11-13-25-27)20-7-9-23(10-8-20)29-17-22(28)16-26-14-12-19-5-3-4-6-21(19)15-26;1-18(2)27-14-12-24(25-27)20-7-9-23(10-8-20)29-17-22(28)16-26-13-11-19-5-3-4-6-21(19)15-26;26-22(16-25-14-11-18-3-1-2-4-21(18)15-25)17-27-23-7-5-19(6-8-23)20-9-12-24-13-10-20/h2-3,6-7,10-13,23-24,28H,4-5,8-9,14-19H2,1H3;2*3-5,8-11,16,20,24,27H,1-2,6-7,12-15,17-19H2;3-11,23,28H,12-17H2,1-2H3;3-11,13,18,22,28H,12,14-17H2,1-2H3;3-10,12,14,18,22,28H,11,13,15-17H2,1-2H3;1-8,20,22,24,26H,9-17H2/t;2*24-;;;;/m.10..../s1
InChIKeySYSCFKSDRNJKDO-LUNNQFHKSA-N
XLogP27.31
TPSA297.63 Ų
H-Bond Donors8
H-Bond Acceptors29
Rotatable Bonds51
Heavy Atoms199
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002694.70
LogP ≤ 527.31
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1029

Analyze (2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol?
The IUPAC name of (2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol (CID 160974738) is (2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol.
What is the SMILES notation for (2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol?
The canonical SMILES for (2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol is CC(C)n1ccc(-c2ccc(OCC(O)CN3CCc4ccccc4C3)cc2)n1.CC(C)n1nccc1-c1ccc(OCC(O)CN2CCc3ccccc3C2)cc1.CN(Cc1ccc(OCC(O)CN2CCc3ccccc3C2)cc1)C1CCCC1.Cc1nn(-c2ccccc2)c(C)c1COCC(O)CN1CCc2ccccc2C1.OC(COc1ccc(C2CCNCC2)cc1)CN1CCc2ccccc2C1.O[C@@H](COc1cccc(CCC2CCCC2)c1)CN1CCc2ccccc2C1.O[C@H](COc1cccc(CCC2CCCC2)c1)CN1CCc2ccccc2C1.
What is the InChIKey of (2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol?
The InChIKey is SYSCFKSDRNJKDO-LUNNQFHKSA-N. The full InChI is InChI=1S/C25H34N2O2.2C25H33NO2.3C24H29N3O2.C23H30N2O2/c1-26(23-8-4-5-9-23)16-20-10-12-25(13-11-20)29-19-24(28)18-27-15-14-21-6-2-3-7-22(21)17-27;2*27-24(18-26-15-14-22-9-3-4-10-23(22)17-26)19-28-25-11-5-8-21(16-25)13-12-20-6-1-2-7-20;1-18-24(19(2)27(25-18)22-10-4-3-5-11-22)17-29-16-23(28)15-26-13-12-20-8-6-7-9-21(20)14-26;1-18(2)27-24(11-13-25-27)20-7-9-23(10-8-20)29-17-22(28)16-26-14-12-19-5-3-4-6-21(19)15-26;1-18(2)27-14-12-24(25-27)20-7-9-23(10-8-20)29-17-22(28)16-26-13-11-19-5-3-4-6-21(19)15-26;26-22(16-25-14-11-18-3-1-2-4-21(18)15-25)17-27-23-7-5-19(6-8-23)20-9-12-24-13-10-20/h2-3,6-7,10-13,23-24,28H,4-5,8-9,14-19H2,1H3;2*3-5,8-11,16,20,24,27H,1-2,6-7,12-15,17-19H2;3-11,23,28H,12-17H2,1-2H3;3-11,13,18,22,28H,12,14-17H2,1-2H3;3-10,12,14,18,22,28H,11,13,15-17H2,1-2H3;1-8,20,22,24,26H,9-17H2/t;2*24-;;;;/m.10..../s1.
What are the key properties of (2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol?
(2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol has a molecular weight of 2694.70 g/mol, XLogP of 27.31, 51 rotatable bonds, 8 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;(2S)-1-[3-(2-cyclopentylethyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[4-[[cyclopentyl(methyl)amino]methyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-piperidin-4-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(1-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[4-(2-propan-2-ylpyrazol-3-yl)phenoxy]propan-2-ol is sourced from PubChem (CID 160974738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).