3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one

C115H185N17O10 — CID 160846069

IUPAC3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one
SMILESCC(C)C(N)C(=O)CC1(Cc2ccccn2)CCN(C(C)C)CC1.CC(C)N1CCC(CC(=O)CCN2CCOCC2)(Cc2ccccn2)CC1.CC(C)N1CCC(CC(=O)CN2CCOCC2)(Cc2ccccn2)CC1.CC(N)C(=O)CC1(Cc2ccccn2)CCN(C(C)C)CC1.CC(O)C(N)C(=O)CC1(Cc2ccccn2)CCN(C(C)C)CC1.COc1ccc(CC2(O)CCN(C(C)C)CC2)cn1
InChIInChI=1S/C22H35N3O2.C21H33N3O2.C20H33N3O.C19H31N3O2.C18H29N3O.C15H24N2O2/c1-19(2)25-11-7-22(8-12-25,17-20-5-3-4-9-23-20)18-21(26)6-10-24-13-15-27-16-14-24;1-18(2)24-9-6-21(7-10-24,15-19-5-3-4-8-22-19)16-20(25)17-23-11-13-26-14-12-23;1-15(2)19(21)18(24)14-20(13-17-7-5-6-10-22-17)8-11-23(12-9-20)16(3)4;1-14(2)22-10-7-19(8-11-22,12-16-6-4-5-9-21-16)13-17(24)18(20)15(3)23;1-14(2)21-10-7-18(8-11-21,13-17(22)15(3)19)12-16-6-4-5-9-20-16;1-12(2)17-8-6-15(18,7-9-17)10-13-4-5-14(19-3)16-11-13/h3-5,9,19H,6-8,10-18H2,1-2H3;3-5,8,18H,6-7,9-17H2,1-2H3;5-7,10,15-16,19H,8-9,11-14,21H2,1-4H3;4-6,9,14-15,18,23H,7-8,10-13,20H2,1-3H3;4-6,9,14-15H,7-8,10-13,19H2,1-3H3;4-5,11-12,18H,6-10H2,1-3H3
InChIKeySIQUWMCRVPTHHA-UHFFFAOYSA-N
MW1965.85 g/mol
LogP14.33
Rot. Bonds39

About 3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one

3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one (PubChem CID 160846069) has the molecular formula C115H185N17O10 and a molecular weight of 1965.85 g/mol. Its IUPAC name is 3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one.

Molecular Properties

Compound Name3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one
PubChem CID160846069
Molecular FormulaC115H185N17O10
Molecular Weight1965.85 g/mol
Exact Mass1964.45
IUPAC Name3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one
SMILESCC(C)C(N)C(=O)CC1(Cc2ccccn2)CCN(C(C)C)CC1.CC(C)N1CCC(CC(=O)CCN2CCOCC2)(Cc2ccccn2)CC1.CC(C)N1CCC(CC(=O)CN2CCOCC2)(Cc2ccccn2)CC1.CC(N)C(=O)CC1(Cc2ccccn2)CCN(C(C)C)CC1.CC(O)C(N)C(=O)CC1(Cc2ccccn2)CCN(C(C)C)CC1.COc1ccc(CC2(O)CCN(C(C)C)CC2)cn1
InChIInChI=1S/C22H35N3O2.C21H33N3O2.C20H33N3O.C19H31N3O2.C18H29N3O.C15H24N2O2/c1-19(2)25-11-7-22(8-12-25,17-20-5-3-4-9-23-20)18-21(26)6-10-24-13-15-27-16-14-24;1-18(2)24-9-6-21(7-10-24,15-19-5-3-4-8-22-19)16-20(25)17-23-11-13-26-14-12-23;1-15(2)19(21)18(24)14-20(13-17-7-5-6-10-22-17)8-11-23(12-9-20)16(3)4;1-14(2)22-10-7-19(8-11-22,12-16-6-4-5-9-21-16)13-17(24)18(20)15(3)23;1-14(2)21-10-7-18(8-11-21,13-17(22)15(3)19)12-16-6-4-5-9-20-16;1-12(2)17-8-6-15(18,7-9-17)10-13-4-5-14(19-3)16-11-13/h3-5,9,19H,6-8,10-18H2,1-2H3;3-5,8,18H,6-7,9-17H2,1-2H3;5-7,10,15-16,19H,8-9,11-14,21H2,1-4H3;4-6,9,14-15,18,23H,7-8,10-13,20H2,1-3H3;4-6,9,14-15H,7-8,10-13,19H2,1-3H3;4-5,11-12,18H,6-10H2,1-3H3
InChIKeySIQUWMCRVPTHHA-UHFFFAOYSA-N
XLogP14.33
TPSA334.82 Ų
H-Bond Donors5
H-Bond Acceptors27
Rotatable Bonds39
Heavy Atoms142
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001965.85
LogP ≤ 514.33
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1027

Analyze 3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one with MolForge

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Launch Full Analysis

Related Compounds

3-Amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-propan-2-yl-4-(pyridin-3-ylmethyl)piperidin-4-ol
CID 157717916
3-Amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(3-chloro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(5-methylpyrazin-2-yl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(6-methyl-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;1-propan-2-yl-4-(pyridin-3-ylmethyl)piperidin-4-ol
CID 158194148
1-(azetidin-3-yl)-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one;1-(dimethylamino)-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one;N,N-dimethyl-1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-amine;1-(4-ethylmorpholin-2-yl)-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one;1-morpholin-2-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one;2-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine;1-propan-2-yl-4-(2-pyridin-3-ylethyl)piperidin-4-ol;1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-ol
CID 158681654
3,3-dimethyl-N-[2-(3-methylphenyl)ethyl]butanamide;3,3-dimethyl-N-[2-(2-methyl-4-pyridinyl)ethyl]butanamide;3,3-dimethyl-N-[2-(6-methyl-3-pyridinyl)ethyl]butanamide;3,3-dimethyl-N-(2-propoxyethyl)butanamide;N-(2-hydroxyethyl)-N-[2-(2-methoxyethoxy)ethyl]-3,3-dimethylbutanamide;N-[2-(2-methoxyethoxy)ethyl]-3,3-dimethylbutanamide;N-[2-(2-methoxyethoxy)ethyl]-N,3,3-trimethylbutanamide;1-[4-(3-methoxypropyl)piperidin-1-yl]-3,3-dimethylbutan-1-one;N-[2-(2-methoxy-4-pyridinyl)ethyl]-3,3-dimethylbutanamide;N-[2-(6-methoxy-3-pyridinyl)ethyl]-3,3-dimethylbutanamide
CID 158812546
3-Amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(6-methyl-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-propan-2-yl-4-(pyridin-3-ylmethyl)piperidin-4-ol
CID 159093324
2-(6-Methoxy-3-pyridinyl)-1-(4-methyl-1-propan-2-ylpiperidin-4-yl)ethanone;1-(4-methyl-1-propan-2-ylpiperidin-4-yl)-2-(5-methyl-2-pyridinyl)ethanone;1-(4-methyl-1-propan-2-ylpiperidin-4-yl)-2-(6-methyl-3-pyridinyl)ethanone;1-(4-methyl-1-propan-2-ylpiperidin-4-yl)-2-pyridin-2-ylethanone;1-(4-methyl-1-propan-2-ylpiperidin-4-yl)-2-pyridin-3-ylethanone
CID 159270455
1-(azetidin-3-yl)-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one;N,N-dimethyl-1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-amine;1-(4-ethylmorpholin-2-yl)-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one;1-morpholin-2-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one;2-[(1-propan-2-ylpiperidin-4-yl)methyl]pyridine;1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-ol;1-propan-2-yl-4-(pyridin-3-ylmethyl)piperidin-4-ol
CID 159594853
3-Amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one
CID 159741538
2-[(5-fluoro-2-pyridinyl)methyl]-N-[1-(2-methyloxiran-2-yl)-1-oxo-3-phenylpropan-2-yl]-5-[(2-morpholin-4-ylacetyl)amino]-4-oxohexanamide;6-hydroxy-2-[(4-methoxyphenyl)methyl]-N-[1-(2-methyloxiran-2-yl)-1-oxo-3-phenylpropan-2-yl]-5-[(2-morpholin-4-ylacetyl)amino]-4-oxohexanamide;2-[(4-methoxyphenyl)methyl]-N-[1-(2-methyloxiran-2-yl)-1-oxo-3-phenylpropan-2-yl]-5-[(2-morpholin-4-ylacetyl)amino]-4-oxopentanamide;2-[(4-methoxyphenyl)methyl]-N-[1-(2-methyloxiran-2-yl)-1-oxo-3-phenylpropan-2-yl]-5-[(2-morpholin-4-ylacetyl)amino]-4-oxo-6-phenylmethoxyhexanamide;N-[1-(2-methyloxiran-2-yl)-1-oxo-3-phenylpropan-2-yl]-5-[(2-morpholin-4-ylacetyl)amino]-4-oxo-2-(pyridin-2-ylmethyl)hexanamide
CID 159889203
3,3-dimethyl-N-[2-(2-methyl-4-pyridinyl)ethyl]butanamide;3,3-dimethyl-N-[2-(6-methyl-3-pyridinyl)ethyl]butanamide;bis(4,4-dimethylpentan-2-one);3,3-dimethyl-N-(2-propoxyethyl)butanamide;ethyl 3,3-dimethylbutanoate;N-(2-hydroxyethyl)-N-[2-(2-methoxyethoxy)ethyl]-3,3-dimethylbutanamide;N-[2-(2-methoxyethoxy)ethyl]-3,3-dimethylbutanamide;N-[2-(2-methoxyethoxy)ethyl]-N,3,3-trimethylbutanamide;1-[4-(2-methoxyethyl)piperidin-1-yl]-3,3-dimethylbutan-1-one;1-[4-(3-methoxypropyl)piperidin-1-yl]-3,3-dimethylbutan-1-one;N-[2-(2-methoxy-4-pyridinyl)ethyl]-3,3-dimethylbutanamide;N-[2-(6-methoxy-3-pyridinyl)ethyl]-3,3-dimethylbutanamide
CID 160151031
3,3-dimethyl-N-[2-(2-methyl-4-pyridinyl)ethyl]butanamide;3,3-dimethyl-N-[2-(6-methyl-3-pyridinyl)ethyl]butanamide;3,3-dimethyl-N-(2-propoxyethyl)butanamide;N-(2-hydroxyethyl)-N-[2-(2-methoxyethoxy)ethyl]-3,3-dimethylbutanamide;N-[2-(2-methoxyethoxy)ethyl]-3,3-dimethylbutanamide;N-[2-(2-methoxyethoxy)ethyl]-N,3,3-trimethylbutanamide;1-[4-(3-methoxypropyl)piperidin-1-yl]-3,3-dimethylbutan-1-one;N-[2-(2-methoxy-4-pyridinyl)ethyl]-3,3-dimethylbutanamide;N-[2-(6-methoxy-3-pyridinyl)ethyl]-3,3-dimethylbutanamide
CID 161582272
(2S,5R,8R,11R,14R,17S,20R,23S,26R,29R,32S)-17-ethyl-14-[(1R,2R)-1-hydroxy-5-(5-methoxy-2-pyridinyl)-2-methylpentyl]-2,4,7,10,13,19,20,22,28,32-decamethyl-5,8,23,29-tetrakis(2-methylpropyl)-11,26-di(propan-2-yl)-1,4,7,10,13,19,22,28-octazacyclotritriacontane-3,6,9,12,15,18,21,24,27,30,33-undecone;(2S,5R,8R,11R,14R,17S,20R,23S,26R,29R,32S)-17-ethyl-14-[(1R,2R)-1-hydroxy-2-methyl-5-(2-methyl-4-pyridinyl)pentyl]-2,4,7,10,13,19,20,22,28,32-decamethyl-5,8,23,29-tetrakis(2-methylpropyl)-11,26-di(propan-2-yl)-1,4,7,10,13,19,22,28-octazacyclotritriacontane-3,6,9,12,15,18,21,24,27,30,33-undecone;(2S,5R,8R,11R,14R,17S,20R,23S,26R,29R,32S)-17-ethyl-14-[(1R,2R)-1-hydroxy-2-methyl-5-pyrazin-2-ylpentyl]-2,4,7,10,13,19,20,22,28,32-decamethyl-5,8,23,29-tetrakis(2-methylpropyl)-11,26-di(propan-2-yl)-1,4,7,10,13,19,22,28-octazacyclotritriacontane-3,6,9,12,15,18,21,24,27,30,33-undecone
CID 161650193

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one?
The IUPAC name of 3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one (CID 160846069) is 3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one.
What is the SMILES notation for 3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one?
The canonical SMILES for 3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one is CC(C)C(N)C(=O)CC1(Cc2ccccn2)CCN(C(C)C)CC1.CC(C)N1CCC(CC(=O)CCN2CCOCC2)(Cc2ccccn2)CC1.CC(C)N1CCC(CC(=O)CN2CCOCC2)(Cc2ccccn2)CC1.CC(N)C(=O)CC1(Cc2ccccn2)CCN(C(C)C)CC1.CC(O)C(N)C(=O)CC1(Cc2ccccn2)CCN(C(C)C)CC1.COc1ccc(CC2(O)CCN(C(C)C)CC2)cn1.
What is the InChIKey of 3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one?
The InChIKey is SIQUWMCRVPTHHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H35N3O2.C21H33N3O2.C20H33N3O.C19H31N3O2.C18H29N3O.C15H24N2O2/c1-19(2)25-11-7-22(8-12-25,17-20-5-3-4-9-23-20)18-21(26)6-10-24-13-15-27-16-14-24;1-18(2)24-9-6-21(7-10-24,15-19-5-3-4-8-22-19)16-20(25)17-23-11-13-26-14-12-23;1-15(2)19(21)18(24)14-20(13-17-7-5-6-10-22-17)8-11-23(12-9-20)16(3)4;1-14(2)22-10-7-19(8-11-22,12-16-6-4-5-9-21-16)13-17(24)18(20)15(3)23;1-14(2)21-10-7-18(8-11-21,13-17(22)15(3)19)12-16-6-4-5-9-20-16;1-12(2)17-8-6-15(18,7-9-17)10-13-4-5-14(19-3)16-11-13/h3-5,9,19H,6-8,10-18H2,1-2H3;3-5,8,18H,6-7,9-17H2,1-2H3;5-7,10,15-16,19H,8-9,11-14,21H2,1-4H3;4-6,9,14-15,18,23H,7-8,10-13,20H2,1-3H3;4-6,9,14-15H,7-8,10-13,19H2,1-3H3;4-5,11-12,18H,6-10H2,1-3H3.
What are the key properties of 3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one?
3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one has a molecular weight of 1965.85 g/mol, XLogP of 14.33, 39 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-morpholin-4-yl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;1-morpholin-4-yl-3-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]propan-2-one is sourced from PubChem (CID 160846069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).