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-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

C122H195FN18O10 — CID 167583768

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-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;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
SMILESCC(C)C(N)C(=O)CC1(Cc2ccccn2)CCN(C(C)C)CC1.CC(C)N1CCC(CC(=O)CCN2CCOCC2)(Cc2ccccn2)CC1.CC(C)N1CCC(O)(Cc2cccnc2)CC1.CC(C)N1CCC(O)(Cc2ncccc2F)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.C20H33N3O.C19H31N3O2.C18H29N3O.C15H24N2O2.C14H21FN2O.C14H22N2O/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;1-15(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;1-11(2)17-8-5-14(18,6-9-17)10-13-12(15)4-3-7-16-13;1-12(2)16-8-5-14(17,6-9-16)10-13-4-3-7-15-11-13/h3-5,9,19H,6-8,10-18H2,1-2H3;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;3-4,7,11,18H,5-6,8-10H2,1-2H3;3-4,7,11-12,17H,5-6,8-10H2,1-2H3
InChIKeyHNEDIMKUWCSBQQ-UHFFFAOYSA-N
MW2093.02 g/mol
LogP15.78
Rot. Bonds38

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-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;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

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-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 (PubChem CID 167583768) has the molecular formula C122H195FN18O10 and a molecular weight of 2093.02 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-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;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.

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-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;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
PubChem CID167583768
Molecular FormulaC122H195FN18O10
Molecular Weight2093.02 g/mol
Exact Mass2091.53
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-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;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
SMILESCC(C)C(N)C(=O)CC1(Cc2ccccn2)CCN(C(C)C)CC1.CC(C)N1CCC(CC(=O)CCN2CCOCC2)(Cc2ccccn2)CC1.CC(C)N1CCC(O)(Cc2cccnc2)CC1.CC(C)N1CCC(O)(Cc2ncccc2F)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.C20H33N3O.C19H31N3O2.C18H29N3O.C15H24N2O2.C14H21FN2O.C14H22N2O/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;1-15(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;1-11(2)17-8-5-14(18,6-9-17)10-13-12(15)4-3-7-16-13;1-12(2)16-8-5-14(17,6-9-16)10-13-4-3-7-15-11-13/h3-5,9,19H,6-8,10-18H2,1-2H3;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;3-4,7,11,18H,5-6,8-10H2,1-2H3;3-4,7,11-12,17H,5-6,8-10H2,1-2H3
InChIKeyHNEDIMKUWCSBQQ-UHFFFAOYSA-N
XLogP15.78
TPSA361.87 Ų
H-Bond Donors7
H-Bond Acceptors28
Rotatable Bonds38
Heavy Atoms151
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002093.02
LogP ≤ 515.78
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1028

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-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;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 with MolForge

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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-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;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?
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-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;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 167583768) 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-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;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.
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-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;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?
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-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;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 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(O)(Cc2cccnc2)CC1.CC(C)N1CCC(O)(Cc2ncccc2F)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-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;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?
The InChIKey is HNEDIMKUWCSBQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H35N3O2.C20H33N3O.C19H31N3O2.C18H29N3O.C15H24N2O2.C14H21FN2O.C14H22N2O/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;1-15(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;1-11(2)17-8-5-14(18,6-9-17)10-13-12(15)4-3-7-16-13;1-12(2)16-8-5-14(17,6-9-16)10-13-4-3-7-15-11-13/h3-5,9,19H,6-8,10-18H2,1-2H3;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;3-4,7,11,18H,5-6,8-10H2,1-2H3;3-4,7,11-12,17H,5-6,8-10H2,1-2H3.
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-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;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?
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-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 has a molecular weight of 2093.02 g/mol, XLogP of 15.78, 38 rotatable bonds, 7 hydrogen bond donors, and 28 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-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;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 is sourced from PubChem (CID 167583768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).