4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol

C100H163N17O8 — CID 159273543

IUPAC4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol
SMILESCC(C)c1ccc(N2CCC(C)(O)CC2)cn1.CC(C)c1ccc(N2CCC(O)(CN(C)C)CC2)cn1.CC(C)c1ccc(N2CCC(O)(CN3CCCC3)CC2)cn1.CC(C)c1ccc(N2CCC(O)(CN3CCN(C)CC3)CC2)cn1.CC(C)c1ccc(N2CCC(O)(CN3CCOCC3)CC2)cn1.COCC1(O)CCN(c2ccc(C(C)C)nc2)CC1
InChIInChI=1S/C19H32N4O.C18H29N3O2.C18H29N3O.C16H27N3O.C15H24N2O2.C14H22N2O/c1-16(2)18-5-4-17(14-20-18)23-8-6-19(24,7-9-23)15-22-12-10-21(3)11-13-22;1-15(2)17-4-3-16(13-19-17)21-7-5-18(22,6-8-21)14-20-9-11-23-12-10-20;1-15(2)17-6-5-16(13-19-17)21-11-7-18(22,8-12-21)14-20-9-3-4-10-20;1-13(2)15-6-5-14(11-17-15)19-9-7-16(20,8-10-19)12-18(3)4;1-12(2)14-5-4-13(10-16-14)17-8-6-15(18,7-9-17)11-19-3;1-11(2)13-5-4-12(10-15-13)16-8-6-14(3,17)7-9-16/h4-5,14,16,24H,6-13,15H2,1-3H3;3-4,13,15,22H,5-12,14H2,1-2H3;5-6,13,15,22H,3-4,7-12,14H2,1-2H3;5-6,11,13,20H,7-10,12H2,1-4H3;4-5,10,12,18H,6-9,11H2,1-3H3;4-5,10-11,17H,6-9H2,1-3H3
InChIKeyKXZWHWOGWKWOLW-UHFFFAOYSA-N
MW1731.51 g/mol
LogP13.12
Rot. Bonds22

About 4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol

4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol (PubChem CID 159273543) has the molecular formula C100H163N17O8 and a molecular weight of 1731.51 g/mol. Its IUPAC name is 4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol.

Molecular Properties

Compound Name4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol
PubChem CID159273543
Molecular FormulaC100H163N17O8
Molecular Weight1731.51 g/mol
Exact Mass1730.29
IUPAC Name4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol
SMILESCC(C)c1ccc(N2CCC(C)(O)CC2)cn1.CC(C)c1ccc(N2CCC(O)(CN(C)C)CC2)cn1.CC(C)c1ccc(N2CCC(O)(CN3CCCC3)CC2)cn1.CC(C)c1ccc(N2CCC(O)(CN3CCN(C)CC3)CC2)cn1.CC(C)c1ccc(N2CCC(O)(CN3CCOCC3)CC2)cn1.COCC1(O)CCN(c2ccc(C(C)C)nc2)CC1
InChIInChI=1S/C19H32N4O.C18H29N3O2.C18H29N3O.C16H27N3O.C15H24N2O2.C14H22N2O/c1-16(2)18-5-4-17(14-20-18)23-8-6-19(24,7-9-23)15-22-12-10-21(3)11-13-22;1-15(2)17-4-3-16(13-19-17)21-7-5-18(22,6-8-21)14-20-9-11-23-12-10-20;1-15(2)17-6-5-16(13-19-17)21-11-7-18(22,8-12-21)14-20-9-3-4-10-20;1-13(2)15-6-5-14(11-17-15)19-9-7-16(20,8-10-19)12-18(3)4;1-12(2)14-5-4-13(10-16-14)17-8-6-15(18,7-9-17)11-19-3;1-11(2)13-5-4-12(10-15-13)16-8-6-14(3,17)7-9-16/h4-5,14,16,24H,6-13,15H2,1-3H3;3-4,13,15,22H,5-12,14H2,1-2H3;5-6,13,15,22H,3-4,7-12,14H2,1-2H3;5-6,11,13,20H,7-10,12H2,1-4H3;4-5,10,12,18H,6-9,11H2,1-3H3;4-5,10-11,17H,6-9H2,1-3H3
InChIKeyKXZWHWOGWKWOLW-UHFFFAOYSA-N
XLogP13.12
TPSA252.82 Ų
H-Bond Donors6
H-Bond Acceptors25
Rotatable Bonds22
Heavy Atoms125
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001731.51
LogP ≤ 513.12
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1025

Analyze 4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol with MolForge

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Launch Full Analysis

Related Compounds

4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(4-methoxy-6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(5-methoxy-6-propan-2-yl-3-pyridinyl)piperidin-4-ol;bis(4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol)
CID 159336239
1-[2-[(dimethylamino)methyl]-6-propan-2-yl-3-pyridinyl]-4-(methoxymethyl)piperidin-4-ol;2-(1,4-dimethylpiperidin-4-yl)-6-propan-2-ylpyridine;(3R)-3-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3S)-3-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;3-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;1-(4-propan-2-ylphenyl)piperidin-4-ol;(3S)-1-[(1S)-1-(6-propan-2-yl-3-pyridinyl)ethyl]piperidin-3-ol;(3R)-1-[1-(6-propan-2-yl-3-pyridinyl)ethyl]piperidin-3-ol;(3S)-1-[1-(6-propan-2-yl-3-pyridinyl)ethyl]piperidin-3-ol
CID 167544669
(3S,4S)-3-fluoro-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;3-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3S)-3-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R)-3-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3R)-3-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;(3S)-3-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;3-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-3-ol;2-[1-(6-propan-2-yl-3-pyridinyl)piperidin-3-yl]propan-2-ol
CID 159921160
3-methyl-1-(6-propan-2-yl-3-pyridinyl)pyrrolidin-3-ol
CID 153422486
1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-4-methylpiperidin-4-ol
CID 83132184
propan-2-ol;4-(6-propan-2-yl-3-pyridinyl)-1,4-oxazepane
CID 172575814
N-methylpropan-2-amine;4-(6-propan-2-yl-3-pyridinyl)morpholine
CID 156652466
propan-2-amine;4-(6-propan-2-yl-3-pyridinyl)morpholine
CID 172576033
1-[6-[(1S)-1-hydroxypropyl]-3-pyridinyl]-4-methylazepan-4-ol
CID 107405251
1-(6-propan-2-yl-3-pyridinyl)azepane
CID 156651925
4-[(4-methylpiperazin-1-yl)methyl]oxan-4-ol
CID 84734865
5-(4,4-difluoropiperidin-1-yl)-2-propan-2-ylpyridine
CID 121261462

Frequently Asked Questions

What is the IUPAC name of 4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol?
The IUPAC name of 4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol (CID 159273543) is 4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol.
What is the SMILES notation for 4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol?
The canonical SMILES for 4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol is CC(C)c1ccc(N2CCC(C)(O)CC2)cn1.CC(C)c1ccc(N2CCC(O)(CN(C)C)CC2)cn1.CC(C)c1ccc(N2CCC(O)(CN3CCCC3)CC2)cn1.CC(C)c1ccc(N2CCC(O)(CN3CCN(C)CC3)CC2)cn1.CC(C)c1ccc(N2CCC(O)(CN3CCOCC3)CC2)cn1.COCC1(O)CCN(c2ccc(C(C)C)nc2)CC1.
What is the InChIKey of 4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol?
The InChIKey is KXZWHWOGWKWOLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N4O.C18H29N3O2.C18H29N3O.C16H27N3O.C15H24N2O2.C14H22N2O/c1-16(2)18-5-4-17(14-20-18)23-8-6-19(24,7-9-23)15-22-12-10-21(3)11-13-22;1-15(2)17-4-3-16(13-19-17)21-7-5-18(22,6-8-21)14-20-9-11-23-12-10-20;1-15(2)17-6-5-16(13-19-17)21-11-7-18(22,8-12-21)14-20-9-3-4-10-20;1-13(2)15-6-5-14(11-17-15)19-9-7-16(20,8-10-19)12-18(3)4;1-12(2)14-5-4-13(10-16-14)17-8-6-15(18,7-9-17)11-19-3;1-11(2)13-5-4-12(10-15-13)16-8-6-14(3,17)7-9-16/h4-5,14,16,24H,6-13,15H2,1-3H3;3-4,13,15,22H,5-12,14H2,1-2H3;5-6,13,15,22H,3-4,7-12,14H2,1-2H3;5-6,11,13,20H,7-10,12H2,1-4H3;4-5,10,12,18H,6-9,11H2,1-3H3;4-5,10-11,17H,6-9H2,1-3H3.
What are the key properties of 4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol?
4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol has a molecular weight of 1731.51 g/mol, XLogP of 13.12, 22 rotatable bonds, 6 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dimethylamino)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(methoxymethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-[(4-methylpiperazin-1-yl)methyl]-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-methyl-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;4-(morpholin-4-ylmethyl)-1-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-(6-propan-2-yl-3-pyridinyl)-4-(pyrrolidin-1-ylmethyl)piperidin-4-ol is sourced from PubChem (CID 159273543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).