(3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone

C172H186Cl10F20N16O18 — CID 160876256

IUPAC(3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone
SMILESCOc1ccc(OCCCCC2(F)CCN(C(=O)c3ccc(F)c(Cl)c3)CC2)nc1.COc1ccnc(OCCCCC2(F)CCN(C(=O)c3ccc(F)c(Cl)c3)CC2)c1.Cc1cccc(OCCCCC2(F)CCN(C(=O)c3ccc(F)c(Cl)c3)CC2)n1.O=C(c1ccc(Cl)c(Cl)c1)N1CCC(F)(CCCCOc2ccccn2)CC1.O=C(c1ccc(F)c(Cl)c1)N1CCC(F)(CCCCOc2cc(F)ccn2)CC1.O=C(c1ccc(F)c(Cl)c1)N1CCC(F)(CCCCOc2ccc(F)cn2)CC1.O=C(c1ccc(F)c(Cl)c1)N1CCC(F)(CCCCOc2cccc(C(F)(F)F)n2)CC1.O=C(c1ccc(F)c(Cl)c1)N1CCC(F)(CCCCOc2cccc(Cl)n2)CC1
InChIInChI=1S/C22H22ClF5N2O2.2C22H25ClF2N2O3.C22H25ClF2N2O2.C21H22Cl2F2N2O2.C21H23Cl2FN2O2.2C21H22ClF3N2O2/c23-16-14-15(6-7-17(16)24)20(31)30-11-9-21(25,10-12-30)8-1-2-13-32-19-5-3-4-18(29-19)22(26,27)28;1-29-17-5-7-20(26-15-17)30-13-3-2-8-22(25)9-11-27(12-10-22)21(28)16-4-6-19(24)18(23)14-16;1-29-17-6-10-26-20(15-17)30-13-3-2-7-22(25)8-11-27(12-9-22)21(28)16-4-5-19(24)18(23)14-16;1-16-5-4-6-20(26-16)29-14-3-2-9-22(25)10-12-27(13-11-22)21(28)17-7-8-19(24)18(23)15-17;22-16-14-15(6-7-17(16)24)20(28)27-11-9-21(25,10-12-27)8-1-2-13-29-19-5-3-4-18(23)26-19;22-17-7-6-16(15-18(17)23)20(27)26-12-9-21(24,10-13-26)8-2-4-14-28-19-5-1-3-11-25-19;22-17-13-15(3-5-18(17)24)20(28)27-10-8-21(25,9-11-27)7-1-2-12-29-19-6-4-16(23)14-26-19;22-17-13-15(3-4-18(17)24)20(28)27-10-7-21(25,8-11-27)6-1-2-12-29-19-14-16(23)5-9-26-19/h3-7,14H,1-2,8-13H2;4-7,14-15H,2-3,8-13H2,1H3;4-6,10,14-15H,2-3,7-9,11-13H2,1H3;4-8,15H,2-3,9-14H2,1H3;3-7,14H,1-2,8-13H2;1,3,5-7,11,15H,2,4,8-10,12-14H2;3-6,13-14H,1-2,7-12H2;3-5,9,13-14H,1-2,6-8,10-12H2
InChIKeySMKWHCTVOHVLRD-UHFFFAOYSA-N
MW3499.96 g/mol
LogP43.33
Rot. Bonds58

About (3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone

(3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone (PubChem CID 160876256) has the molecular formula C172H186Cl10F20N16O18 and a molecular weight of 3499.96 g/mol. Its IUPAC name is (3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone
PubChem CID160876256
Molecular FormulaC172H186Cl10F20N16O18
Molecular Weight3499.96 g/mol
Exact Mass3493.07
IUPAC Name(3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone
SMILESCOc1ccc(OCCCCC2(F)CCN(C(=O)c3ccc(F)c(Cl)c3)CC2)nc1.COc1ccnc(OCCCCC2(F)CCN(C(=O)c3ccc(F)c(Cl)c3)CC2)c1.Cc1cccc(OCCCCC2(F)CCN(C(=O)c3ccc(F)c(Cl)c3)CC2)n1.O=C(c1ccc(Cl)c(Cl)c1)N1CCC(F)(CCCCOc2ccccn2)CC1.O=C(c1ccc(F)c(Cl)c1)N1CCC(F)(CCCCOc2cc(F)ccn2)CC1.O=C(c1ccc(F)c(Cl)c1)N1CCC(F)(CCCCOc2ccc(F)cn2)CC1.O=C(c1ccc(F)c(Cl)c1)N1CCC(F)(CCCCOc2cccc(C(F)(F)F)n2)CC1.O=C(c1ccc(F)c(Cl)c1)N1CCC(F)(CCCCOc2cccc(Cl)n2)CC1
InChIInChI=1S/C22H22ClF5N2O2.2C22H25ClF2N2O3.C22H25ClF2N2O2.C21H22Cl2F2N2O2.C21H23Cl2FN2O2.2C21H22ClF3N2O2/c23-16-14-15(6-7-17(16)24)20(31)30-11-9-21(25,10-12-30)8-1-2-13-32-19-5-3-4-18(29-19)22(26,27)28;1-29-17-5-7-20(26-15-17)30-13-3-2-8-22(25)9-11-27(12-10-22)21(28)16-4-6-19(24)18(23)14-16;1-29-17-6-10-26-20(15-17)30-13-3-2-7-22(25)8-11-27(12-9-22)21(28)16-4-5-19(24)18(23)14-16;1-16-5-4-6-20(26-16)29-14-3-2-9-22(25)10-12-27(13-11-22)21(28)17-7-8-19(24)18(23)15-17;22-16-14-15(6-7-17(16)24)20(28)27-11-9-21(25,10-12-27)8-1-2-13-29-19-5-3-4-18(23)26-19;22-17-7-6-16(15-18(17)23)20(27)26-12-9-21(24,10-13-26)8-2-4-14-28-19-5-1-3-11-25-19;22-17-13-15(3-5-18(17)24)20(28)27-10-8-21(25,9-11-27)7-1-2-12-29-19-6-4-16(23)14-26-19;22-17-13-15(3-4-18(17)24)20(28)27-10-7-21(25,8-11-27)6-1-2-12-29-19-14-16(23)5-9-26-19/h3-7,14H,1-2,8-13H2;4-7,14-15H,2-3,8-13H2,1H3;4-6,10,14-15H,2-3,7-9,11-13H2,1H3;4-8,15H,2-3,9-14H2,1H3;3-7,14H,1-2,8-13H2;1,3,5-7,11,15H,2,4,8-10,12-14H2;3-6,13-14H,1-2,7-12H2;3-5,9,13-14H,1-2,6-8,10-12H2
InChIKeySMKWHCTVOHVLRD-UHFFFAOYSA-N
XLogP43.33
TPSA357.90 Ų
H-Bond Donors
H-Bond Acceptors26
Rotatable Bonds58
Heavy Atoms236
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003499.96
LogP ≤ 543.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze (3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-Chloro-4-fluorophenyl)-[4-[4-[(5-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(3-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-(4-pyridin-3-yloxybutyl)piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-(4-pyridin-4-yloxybutyl)piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-quinolin-8-yloxybutyl)piperidin-1-yl]methanone
CID 158203479
6-[(2-chloro-4-pyridinyl)oxymethyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;6-[(2-chloro-4-pyridinyl)oxymethyl]-N-[(2R)-3,3-dimethylbutan-2-yl]pyridine-3-carboxamide;N-(1-cyclohexylethyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(5-fluoro-3-pyridinyl)oxymethyl]pyridine-3-carboxamide;N-(3,3-difluorobutan-2-yl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide;6-[(3-fluorophenoxy)methyl]-N-[1-(oxan-2-yl)ethyl]pyridine-3-carboxamide
CID 158886903
5-chloro-2-fluoro-N-(3-pyridin-3-yloxyphenyl)benzamide;3-(1,1-difluoroethyl)-N-(3-pyridin-3-yloxyphenyl)benzamide;methane;6-methoxy-N-(3-pyridin-3-yloxyphenyl)pyridine-2-carboxamide;6-methyl-N-(3-pyridin-3-yloxyphenyl)pyridine-2-carboxamide;3-methyl-N-[3-[[5-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide
CID 159755322
6-[(2-chloro-4-pyridinyl)oxymethyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;6-[(2-chloro-4-pyridinyl)oxymethyl]-N-[(2R)-3,3-dimethylbutan-2-yl]pyridine-3-carboxamide;N-(1-cyclohexylethyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(5-fluoro-3-pyridinyl)oxymethyl]pyridine-3-carboxamide;N-(3,3-difluorobutan-2-yl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide;6-[(3-fluorophenoxy)methyl]-N-[1-(oxan-2-yl)ethyl]pyridine-3-carboxamide;methane
CID 161427242
5-chloro-2-fluoro-N-(3-pyridin-3-yloxyphenyl)benzamide;3-ethynyl-N-(3-pyridin-3-yloxyphenyl)benzamide;3-ethynyl-N-[3-[[5-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]benzamide;N-[3-[(5-fluoro-3-pyridinyl)oxy]phenyl]-3-methylbenzamide;methane;3-methyl-N-[3-[(6-methyl-3-pyridinyl)oxy]phenyl]benzamide
CID 162003803

Frequently Asked Questions

What is the IUPAC name of (3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone?
The IUPAC name of (3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone (CID 160876256) is (3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone.
What is the SMILES notation for (3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone?
The canonical SMILES for (3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone is COc1ccc(OCCCCC2(F)CCN(C(=O)c3ccc(F)c(Cl)c3)CC2)nc1.COc1ccnc(OCCCCC2(F)CCN(C(=O)c3ccc(F)c(Cl)c3)CC2)c1.Cc1cccc(OCCCCC2(F)CCN(C(=O)c3ccc(F)c(Cl)c3)CC2)n1.O=C(c1ccc(Cl)c(Cl)c1)N1CCC(F)(CCCCOc2ccccn2)CC1.O=C(c1ccc(F)c(Cl)c1)N1CCC(F)(CCCCOc2cc(F)ccn2)CC1.O=C(c1ccc(F)c(Cl)c1)N1CCC(F)(CCCCOc2ccc(F)cn2)CC1.O=C(c1ccc(F)c(Cl)c1)N1CCC(F)(CCCCOc2cccc(C(F)(F)F)n2)CC1.O=C(c1ccc(F)c(Cl)c1)N1CCC(F)(CCCCOc2cccc(Cl)n2)CC1.
What is the InChIKey of (3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone?
The InChIKey is SMKWHCTVOHVLRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22ClF5N2O2.2C22H25ClF2N2O3.C22H25ClF2N2O2.C21H22Cl2F2N2O2.C21H23Cl2FN2O2.2C21H22ClF3N2O2/c23-16-14-15(6-7-17(16)24)20(31)30-11-9-21(25,10-12-30)8-1-2-13-32-19-5-3-4-18(29-19)22(26,27)28;1-29-17-5-7-20(26-15-17)30-13-3-2-8-22(25)9-11-27(12-10-22)21(28)16-4-6-19(24)18(23)14-16;1-29-17-6-10-26-20(15-17)30-13-3-2-7-22(25)8-11-27(12-9-22)21(28)16-4-5-19(24)18(23)14-16;1-16-5-4-6-20(26-16)29-14-3-2-9-22(25)10-12-27(13-11-22)21(28)17-7-8-19(24)18(23)15-17;22-16-14-15(6-7-17(16)24)20(28)27-11-9-21(25,10-12-27)8-1-2-13-29-19-5-3-4-18(23)26-19;22-17-7-6-16(15-18(17)23)20(27)26-12-9-21(24,10-13-26)8-2-4-14-28-19-5-1-3-11-25-19;22-17-13-15(3-5-18(17)24)20(28)27-10-8-21(25,9-11-27)7-1-2-12-29-19-6-4-16(23)14-26-19;22-17-13-15(3-4-18(17)24)20(28)27-10-7-21(25,8-11-27)6-1-2-12-29-19-14-16(23)5-9-26-19/h3-7,14H,1-2,8-13H2;4-7,14-15H,2-3,8-13H2,1H3;4-6,10,14-15H,2-3,7-9,11-13H2,1H3;4-8,15H,2-3,9-14H2,1H3;3-7,14H,1-2,8-13H2;1,3,5-7,11,15H,2,4,8-10,12-14H2;3-6,13-14H,1-2,7-12H2;3-5,9,13-14H,1-2,6-8,10-12H2.
What are the key properties of (3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone?
(3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone has a molecular weight of 3499.96 g/mol, XLogP of 43.33, 58 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-4-fluorophenyl)-[4-[4-[(6-chloro-2-pyridinyl)oxy]butyl]-4-fluoropiperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-fluoro-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(4-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(5-methoxy-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[(6-methyl-2-pyridinyl)oxy]butyl]piperidin-1-yl]methanone;(3-chloro-4-fluorophenyl)-[4-fluoro-4-[4-[[6-(trifluoromethyl)-2-pyridinyl]oxy]butyl]piperidin-1-yl]methanone;(3,4-dichlorophenyl)-[4-fluoro-4-(4-pyridin-2-yloxybutyl)piperidin-1-yl]methanone is sourced from PubChem (CID 160876256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).