[6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone

C105H113ClN10O6 — CID 161256838

IUPAC[6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone
SMILESCC1CCN(C(=O)c2cccc(-c3ccc(-c4ccccc4)cc3)n2)CC1.CC1CCN(C(=O)c2cccc(-c3ccc(Oc4ccccc4)cc3)n2)CC1.Cc1ccc(-c2cccc(C(=O)N3CCC(C)CC3)n2)cc1Cl.Cc1cccc(-c2cccc(C(=O)N3CCC(C)CC3)n2)c1.Cc1ccccc1-c1cccc(C(=O)N2CCC(C)CC2)n1
InChIInChI=1S/C24H24N2O2.C24H24N2O.C19H21ClN2O.2C19H22N2O/c1-18-14-16-26(17-15-18)24(27)23-9-5-8-22(25-23)19-10-12-21(13-11-19)28-20-6-3-2-4-7-20;1-18-14-16-26(17-15-18)24(27)23-9-5-8-22(25-23)21-12-10-20(11-13-21)19-6-3-2-4-7-19;1-13-8-10-22(11-9-13)19(23)18-5-3-4-17(21-18)15-7-6-14(2)16(20)12-15;1-14-9-11-21(12-10-14)19(22)18-8-4-7-17(20-18)16-6-3-5-15(2)13-16;1-14-10-12-21(13-11-14)19(22)18-9-5-8-17(20-18)16-7-4-3-6-15(16)2/h2-13,18H,14-17H2,1H3;2-13,18H,14-17H2,1H3;3-7,12-13H,8-11H2,1-2H3;3-8,13-14H,9-12H2,1-2H3;3-9,14H,10-13H2,1-2H3
InChIKeyVCAMNWRKHKDMHA-UHFFFAOYSA-N
MW1646.58 g/mol
LogP23.14
Rot. Bonds13

About [6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone

[6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone (PubChem CID 161256838) has the molecular formula C105H113ClN10O6 and a molecular weight of 1646.58 g/mol. Its IUPAC name is [6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone.

Molecular Properties

Compound Name[6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone
PubChem CID161256838
Molecular FormulaC105H113ClN10O6
Molecular Weight1646.58 g/mol
Exact Mass1644.85
IUPAC Name[6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone
SMILESCC1CCN(C(=O)c2cccc(-c3ccc(-c4ccccc4)cc3)n2)CC1.CC1CCN(C(=O)c2cccc(-c3ccc(Oc4ccccc4)cc3)n2)CC1.Cc1ccc(-c2cccc(C(=O)N3CCC(C)CC3)n2)cc1Cl.Cc1cccc(-c2cccc(C(=O)N3CCC(C)CC3)n2)c1.Cc1ccccc1-c1cccc(C(=O)N2CCC(C)CC2)n1
InChIInChI=1S/C24H24N2O2.C24H24N2O.C19H21ClN2O.2C19H22N2O/c1-18-14-16-26(17-15-18)24(27)23-9-5-8-22(25-23)19-10-12-21(13-11-19)28-20-6-3-2-4-7-20;1-18-14-16-26(17-15-18)24(27)23-9-5-8-22(25-23)21-12-10-20(11-13-21)19-6-3-2-4-7-19;1-13-8-10-22(11-9-13)19(23)18-5-3-4-17(21-18)15-7-6-14(2)16(20)12-15;1-14-9-11-21(12-10-14)19(22)18-8-4-7-17(20-18)16-6-3-5-15(2)13-16;1-14-10-12-21(13-11-14)19(22)18-9-5-8-17(20-18)16-7-4-3-6-15(16)2/h2-13,18H,14-17H2,1H3;2-13,18H,14-17H2,1H3;3-7,12-13H,8-11H2,1-2H3;3-8,13-14H,9-12H2,1-2H3;3-9,14H,10-13H2,1-2H3
InChIKeyVCAMNWRKHKDMHA-UHFFFAOYSA-N
XLogP23.14
TPSA175.23 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds13
Heavy Atoms122
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001646.58
LogP ≤ 523.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze [6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone with MolForge

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Related Compounds

[6-[2,4-Bis(trifluoromethyl)phenyl]-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2,5-dichlorophenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2,5-difluorophenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2,3-dimethylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-fluoro-3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(6-methoxy-3-pyridinyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;2-[6-(4-methylpiperidine-1-carbonyl)-2-pyridinyl]benzonitrile
CID 159612320
[6-(2-Chloro-3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-[4-(1,1-difluoroethoxy)phenyl]-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-[4-(dimethylamino)phenyl]-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-fluoro-5-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(3-phenylphenyl)-2-pyridinyl]methanone
CID 159674606
N-(1-adamantyl)-6-(2-chlorophenyl)pyridine-2-carboxamide;N-(1-adamantyl)-6-(2,3-dihydro-1-benzofuran-5-yl)pyridine-2-carboxamide;N-(1-adamantyl)-6-(2-fluorophenyl)pyridine-2-carboxamide;N-(1-adamantyl)-6-(2-methoxyphenyl)pyridine-2-carboxamide;N-(1-adamantyl)-6-pyridin-4-ylpyridine-2-carboxamide;N-(1-adamantyl)-6-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 160078017
[6-[(3-Chloro-4-methylphenoxy)methyl]-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-[[4-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-[(3-methylphenoxy)methyl]-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;bis([6-[(4-methylphenoxy)methyl]-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone);(4-methylpiperidin-1-yl)-[6-[(4-phenylphenoxy)methyl]-2-pyridinyl]methanone
CID 161046343
7-(3-Chlorophenyl)-1-[4-(1-methoxy-6-methylisoquinoline-3-carbonyl)-2,2-dimethylpiperazin-1-yl]-3-methyl-2-methyliminohept-5-en-1-one
CID 123157251
[6-(3,4-Dimethylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-fluoro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(2-phenoxyphenyl)-2-pyridinyl]methanone
CID 123798115
6-(2-chlorophenyl)-4-[1-[6-(2-chlorophenyl)pyridine-2-carbonyl]-4-(4-methylphenoxy)piperidin-2-yl]-N,N-diethylpyridine-2-carboxamide
CID 143311251
[4-Chloro-6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]-(4-methylpiperazin-1-yl)methanone;[4-ethenyl-6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]-(4-methylpiperazin-1-yl)methanone;2-ethenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 157566924
Tert-butyl 4-(4,6-dichloropyridine-2-carbonyl)piperidine-1-carboxylate;[4-chloro-6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]-(4-methylpiperazin-1-yl)methanone;2-[4-(4-fluorophenoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 157573237
3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl-[6-(2-chlorophenyl)-2-pyridinyl]methanone;3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl-[6-(2-chlorophenyl)-2-pyridinyl]methanone;azepan-1-yl-[6-(2-chlorophenyl)-2-pyridinyl]methanone;6-(2-chlorophenyl)-N,N-diethylpyridine-2-carboxamide;[6-(2-chlorophenyl)-2-pyridinyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone;[6-(2-chlorophenyl)-2-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone;[6-(2-chlorophenyl)-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-(2-chlorophenyl)-2-pyridinyl]-[4-(4-methylphenoxy)piperidin-1-yl]methanone;[6-(2-methylphenyl)-2-pyridinyl]-(2-methylpyrrolidin-1-yl)methanone
CID 157676355
[6-(3,4-Dimethoxyphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3,4-dimethylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-(6-phenyl-2-pyridinyl)methanone;(4-methylpiperidin-1-yl)-[6-(3-propan-2-ylphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-propan-2-ylphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(2,4,6-trichlorophenyl)-2-pyridinyl]methanone
CID 157797691
[4-Chloro-6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]-(4-methylpiperazin-1-yl)methanone;(4,6-dichloro-2-pyridinyl)-(4-methylpiperazin-1-yl)methanone;2-[4-(4-fluorophenoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 159268188

Frequently Asked Questions

What is the IUPAC name of [6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone?
The IUPAC name of [6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone (CID 161256838) is [6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone.
What is the SMILES notation for [6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone?
The canonical SMILES for [6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone is CC1CCN(C(=O)c2cccc(-c3ccc(-c4ccccc4)cc3)n2)CC1.CC1CCN(C(=O)c2cccc(-c3ccc(Oc4ccccc4)cc3)n2)CC1.Cc1ccc(-c2cccc(C(=O)N3CCC(C)CC3)n2)cc1Cl.Cc1cccc(-c2cccc(C(=O)N3CCC(C)CC3)n2)c1.Cc1ccccc1-c1cccc(C(=O)N2CCC(C)CC2)n1.
What is the InChIKey of [6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone?
The InChIKey is VCAMNWRKHKDMHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O2.C24H24N2O.C19H21ClN2O.2C19H22N2O/c1-18-14-16-26(17-15-18)24(27)23-9-5-8-22(25-23)19-10-12-21(13-11-19)28-20-6-3-2-4-7-20;1-18-14-16-26(17-15-18)24(27)23-9-5-8-22(25-23)21-12-10-20(11-13-21)19-6-3-2-4-7-19;1-13-8-10-22(11-9-13)19(23)18-5-3-4-17(21-18)15-7-6-14(2)16(20)12-15;1-14-9-11-21(12-10-14)19(22)18-8-4-7-17(20-18)16-6-3-5-15(2)13-16;1-14-10-12-21(13-11-14)19(22)18-9-5-8-17(20-18)16-7-4-3-6-15(16)2/h2-13,18H,14-17H2,1H3;2-13,18H,14-17H2,1H3;3-7,12-13H,8-11H2,1-2H3;3-8,13-14H,9-12H2,1-2H3;3-9,14H,10-13H2,1-2H3.
What are the key properties of [6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone?
[6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone has a molecular weight of 1646.58 g/mol, XLogP of 23.14, 13 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-chloro-4-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(2-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;[6-(3-methylphenyl)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone;(4-methylpiperidin-1-yl)-[6-(4-phenoxyphenyl)-2-pyridinyl]methanone;(4-methylpiperidin-1-yl)-[6-(4-phenylphenyl)-2-pyridinyl]methanone is sourced from PubChem (CID 161256838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).