2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine

C142H183N21O9 — CID 159068593

IUPAC2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine
SMILESO=C(Cc1ccccc1)CC1CCN(c2cncc(OC[C@@H]3CCCN3)c2)CC1.OCC[C@@H]1CCN(c2cncc(OC[C@@H]3CCN3)c2)C1.c1ccc(C[C@@H]2CCN(c3cncc(OC[C@@H]4CCCN4)c3)C2)cc1.c1ccc(C[C@H]2CCN(c3cncc(OC[C@@H]4CCCN4)c3)C2)cc1.c1ccc([C@@H]2CCN(c3cncc(OC[C@@H]4CCCN4)c3)C2)cc1.c1ccc([C@H]2CCN(c3cncc(OC[C@@H]4CCCN4)c3)C2)cc1.c1ccc([C@]23C[C@H]2CN(c2cncc(OC[C@@H]4CCCN4)c2)C3)cc1
InChIInChI=1S/C24H31N3O2.C21H25N3O.2C21H27N3O.2C20H25N3O.C15H23N3O2/c28-23(13-19-5-2-1-3-6-19)14-20-8-11-27(12-9-20)22-15-24(17-25-16-22)29-18-21-7-4-10-26-21;1-2-5-16(6-3-1)21-10-17(21)13-24(15-21)19-9-20(12-22-11-19)25-14-18-7-4-8-23-18;2*1-2-5-17(6-3-1)11-18-8-10-24(15-18)20-12-21(14-22-13-20)25-16-19-7-4-9-23-19;2*1-2-5-16(6-3-1)17-8-10-23(14-17)19-11-20(13-21-12-19)24-15-18-7-4-9-22-18;19-6-3-12-2-5-18(10-12)14-7-15(9-16-8-14)20-11-13-1-4-17-13/h1-3,5-6,15-17,20-21,26H,4,7-14,18H2;1-3,5-6,9,11-12,17-18,23H,4,7-8,10,13-15H2;2*1-3,5-6,12-14,18-19,23H,4,7-11,15-16H2;2*1-3,5-6,11-13,17-18,22H,4,7-10,14-15H2;7-9,12-13,17,19H,1-6,10-11H2/t21-;17-,18-,21+;18-,19+;18-,19-;17-,18+;17-,18-;12-,13-/m0010100/s1
InChIKeyJZIZXCBFZBLLKH-GXTIKLCASA-N
MW2328.16 g/mol
LogP20.63
Rot. Bonds41

About 2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine

2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine (PubChem CID 159068593) has the molecular formula C142H183N21O9 and a molecular weight of 2328.16 g/mol. Its IUPAC name is 2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine.

Molecular Properties

Compound Name2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine
PubChem CID159068593
Molecular FormulaC142H183N21O9
Molecular Weight2328.16 g/mol
Exact Mass2326.45
IUPAC Name2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine
SMILESO=C(Cc1ccccc1)CC1CCN(c2cncc(OC[C@@H]3CCCN3)c2)CC1.OCC[C@@H]1CCN(c2cncc(OC[C@@H]3CCN3)c2)C1.c1ccc(C[C@@H]2CCN(c3cncc(OC[C@@H]4CCCN4)c3)C2)cc1.c1ccc(C[C@H]2CCN(c3cncc(OC[C@@H]4CCCN4)c3)C2)cc1.c1ccc([C@@H]2CCN(c3cncc(OC[C@@H]4CCCN4)c3)C2)cc1.c1ccc([C@H]2CCN(c3cncc(OC[C@@H]4CCCN4)c3)C2)cc1.c1ccc([C@]23C[C@H]2CN(c2cncc(OC[C@@H]4CCCN4)c2)C3)cc1
InChIInChI=1S/C24H31N3O2.C21H25N3O.2C21H27N3O.2C20H25N3O.C15H23N3O2/c28-23(13-19-5-2-1-3-6-19)14-20-8-11-27(12-9-20)22-15-24(17-25-16-22)29-18-21-7-4-10-26-21;1-2-5-16(6-3-1)21-10-17(21)13-24(15-21)19-9-20(12-22-11-19)25-14-18-7-4-8-23-18;2*1-2-5-17(6-3-1)11-18-8-10-24(15-18)20-12-21(14-22-13-20)25-16-19-7-4-9-23-19;2*1-2-5-16(6-3-1)17-8-10-23(14-17)19-11-20(13-21-12-19)24-15-18-7-4-9-22-18;19-6-3-12-2-5-18(10-12)14-7-15(9-16-8-14)20-11-13-1-4-17-13/h1-3,5-6,15-17,20-21,26H,4,7-14,18H2;1-3,5-6,9,11-12,17-18,23H,4,7-8,10,13-15H2;2*1-3,5-6,12-14,18-19,23H,4,7-11,15-16H2;2*1-3,5-6,11-13,17-18,22H,4,7-10,14-15H2;7-9,12-13,17,19H,1-6,10-11H2/t21-;17-,18-,21+;18-,19+;18-,19-;17-,18+;17-,18-;12-,13-/m0010100/s1
InChIKeyJZIZXCBFZBLLKH-GXTIKLCASA-N
XLogP20.63
TPSA299.03 Ų
H-Bond Donors8
H-Bond Acceptors30
Rotatable Bonds41
Heavy Atoms172
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002328.16
LogP ≤ 520.63
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1030

Analyze 2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine with MolForge

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Launch Full Analysis

Related Compounds

3-[4-[4-(furan-2-yl)butyl]piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(2S)-2-(4-phenylmethoxybutyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(2R)-2-(4-phenylmethoxybutyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-(3-phenylmethoxypropyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-(3-phenylmethoxypropyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[4-(4-pyridin-3-ylbutyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine
CID 157563585
3-[[(2R)-azetidin-2-yl]methoxy]-5-[4-(2-phenylmethoxyethyl)piperidin-1-yl]pyridine;3-[4-(2-cyclobutyloxyethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[4-[2-(cyclopropylmethoxy)ethyl]piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[4-(2-phenylmethoxyethyl)piperidin-1-yl]-5-(piperidin-2-ylmethoxy)pyridine;3-[4-(2-phenylmethoxyethyl)piperidin-1-yl]-5-[[(2S)-piperidin-2-yl]methoxy]pyridine
CID 157872164
(1S,5S)-1-benzyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;(1R,5R)-1-benzyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;(1R,5S)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;(1S,5S)-1-(pyridin-4-ylmethyl)-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;3-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;2-[(1R,5R)-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexan-1-yl]ethanol
CID 158155034
3-[(3R)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]propan-1-ol;3-[(3R)-3-(3-phenylpropoxymethyl)pyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;2-[(3S)-1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;2-[(3S)-1-[5-(pyrrolidin-2-ylmethoxy)-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]propan-1-ol;3-[(3R)-1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]propan-1-ol;3-[(3R)-1-[5-(pyrrolidin-2-ylmethoxy)-3-pyridinyl]pyrrolidin-3-yl]propan-1-ol
CID 159040854
(8R)-8-(2-phenylmethoxyethyl)-2-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline;(8S)-8-(2-phenylmethoxyethyl)-2-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline;(7S)-7-(phenylmethoxymethyl)-2-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline;5-(phenylmethoxymethyl)-2-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3,4-dihydro-1H-isoquinoline;6-phenylmethoxy-2-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3,4-dihydro-1H-isoquinoline
CID 159140817
3-[4-[2-[4-(methoxymethyl)phenyl]ethyl]piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[4-[2-[(4-methoxyphenyl)methoxy]ethyl]piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[4-(4-phenylmethoxybutyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[4-(phenylmethoxymethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[4-(3-phenylmethoxypropyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine
CID 159477841
bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine
CID 159732705
(5R)-5-(phenylmethoxymethyl)-2-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline;(5S)-5-(phenylmethoxymethyl)-2-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline;(7R)-7-(phenylmethoxymethyl)-2-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline;(6R)-6-phenylmethoxy-2-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline;(6S)-6-phenylmethoxy-2-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline
CID 159762977
3-[(2S)-2-(4-phenylmethoxybutyl)pyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(2R)-2-(4-phenylmethoxybutyl)pyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[3-(3-phenylmethoxypropyl)azetidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-(3-phenylmethoxypropyl)pyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-(3-phenylmethoxypropyl)pyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine
CID 162228170

Frequently Asked Questions

What is the IUPAC name of 2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine?
The IUPAC name of 2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine (CID 159068593) is 2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine.
What is the SMILES notation for 2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine?
The canonical SMILES for 2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine is O=C(Cc1ccccc1)CC1CCN(c2cncc(OC[C@@H]3CCCN3)c2)CC1.OCC[C@@H]1CCN(c2cncc(OC[C@@H]3CCN3)c2)C1.c1ccc(C[C@@H]2CCN(c3cncc(OC[C@@H]4CCCN4)c3)C2)cc1.c1ccc(C[C@H]2CCN(c3cncc(OC[C@@H]4CCCN4)c3)C2)cc1.c1ccc([C@@H]2CCN(c3cncc(OC[C@@H]4CCCN4)c3)C2)cc1.c1ccc([C@H]2CCN(c3cncc(OC[C@@H]4CCCN4)c3)C2)cc1.c1ccc([C@]23C[C@H]2CN(c2cncc(OC[C@@H]4CCCN4)c2)C3)cc1.
What is the InChIKey of 2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine?
The InChIKey is JZIZXCBFZBLLKH-GXTIKLCASA-N. The full InChI is InChI=1S/C24H31N3O2.C21H25N3O.2C21H27N3O.2C20H25N3O.C15H23N3O2/c28-23(13-19-5-2-1-3-6-19)14-20-8-11-27(12-9-20)22-15-24(17-25-16-22)29-18-21-7-4-10-26-21;1-2-5-16(6-3-1)21-10-17(21)13-24(15-21)19-9-20(12-22-11-19)25-14-18-7-4-8-23-18;2*1-2-5-17(6-3-1)11-18-8-10-24(15-18)20-12-21(14-22-13-20)25-16-19-7-4-9-23-19;2*1-2-5-16(6-3-1)17-8-10-23(14-17)19-11-20(13-21-12-19)24-15-18-7-4-9-22-18;19-6-3-12-2-5-18(10-12)14-7-15(9-16-8-14)20-11-13-1-4-17-13/h1-3,5-6,15-17,20-21,26H,4,7-14,18H2;1-3,5-6,9,11-12,17-18,23H,4,7-8,10,13-15H2;2*1-3,5-6,12-14,18-19,23H,4,7-11,15-16H2;2*1-3,5-6,11-13,17-18,22H,4,7-10,14-15H2;7-9,12-13,17,19H,1-6,10-11H2/t21-;17-,18-,21+;18-,19+;18-,19-;17-,18+;17-,18-;12-,13-/m0010100/s1.
What are the key properties of 2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine?
2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine has a molecular weight of 2328.16 g/mol, XLogP of 20.63, 41 rotatable bonds, 8 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3S)-1-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]pyrrolidin-3-yl]ethanol;3-[(3S)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3R)-3-benzylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;(1S,5R)-1-phenyl-3-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-3-azabicyclo[3.1.0]hexane;1-phenyl-3-[1-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]piperidin-4-yl]propan-2-one;3-[(3R)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[(3S)-3-phenylpyrrolidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine is sourced from PubChem (CID 159068593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).