4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine

C113H120F5N15OS — CID 165067612

IUPAC4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine
SMILESCC1CC(c2cc(-c3ccncc3)c(-c3ccc(F)cc3)[nH]2)CCN1C.CC1CN(C)CCC1c1cc(-c2ccncc2)c(-c2ccc(F)cc2)[nH]1.CN1CCC(c2cc(-c3ccncc3)c(-c3ccc(-c4ccsc4)cc3)[nH]2)CC1.CN1CCC(c2cc(-c3ccncc3)c(-c3ccc(C(F)(F)F)cc3)[nH]2)CC1.COc1ccc(-c2[nH]c(C3CCN(C)CC3)cc2-c2ccncc2)cc1
InChIInChI=1S/C25H25N3S.C22H22F3N3.2C22H24FN3.C22H25N3O/c1-28-13-8-20(9-14-28)24-16-23(19-6-11-26-12-7-19)25(27-24)21-4-2-18(3-5-21)22-10-15-29-17-22;1-28-12-8-16(9-13-28)20-14-19(15-6-10-26-11-7-15)21(27-20)17-2-4-18(5-3-17)22(23,24)25;1-15-14-26(2)12-9-19(15)21-13-20(16-7-10-24-11-8-16)22(25-21)17-3-5-18(23)6-4-17;1-15-13-18(9-12-26(15)2)21-14-20(16-7-10-24-11-8-16)22(25-21)17-3-5-19(23)6-4-17;1-25-13-9-17(10-14-25)21-15-20(16-7-11-23-12-8-16)22(24-21)18-3-5-19(26-2)6-4-18/h2-7,10-12,15-17,20,27H,8-9,13-14H2,1H3;2-7,10-11,14,16,27H,8-9,12-13H2,1H3;3-8,10-11,13,15,19,25H,9,12,14H2,1-2H3;3-8,10-11,14-15,18,25H,9,12-13H2,1-2H3;3-8,11-12,15,17,24H,9-10,13-14H2,1-2H3
InChIKeySFOKAZOIKAZFFO-UHFFFAOYSA-N
MW1831.36 g/mol
LogP26.43
Rot. Bonds17

About 4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine

4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine (PubChem CID 165067612) has the molecular formula C113H120F5N15OS and a molecular weight of 1831.36 g/mol. Its IUPAC name is 4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine.

Molecular Properties

Compound Name4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine
PubChem CID165067612
Molecular FormulaC113H120F5N15OS
Molecular Weight1831.36 g/mol
Exact Mass1829.94
IUPAC Name4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine
SMILESCC1CC(c2cc(-c3ccncc3)c(-c3ccc(F)cc3)[nH]2)CCN1C.CC1CN(C)CCC1c1cc(-c2ccncc2)c(-c2ccc(F)cc2)[nH]1.CN1CCC(c2cc(-c3ccncc3)c(-c3ccc(-c4ccsc4)cc3)[nH]2)CC1.CN1CCC(c2cc(-c3ccncc3)c(-c3ccc(C(F)(F)F)cc3)[nH]2)CC1.COc1ccc(-c2[nH]c(C3CCN(C)CC3)cc2-c2ccncc2)cc1
InChIInChI=1S/C25H25N3S.C22H22F3N3.2C22H24FN3.C22H25N3O/c1-28-13-8-20(9-14-28)24-16-23(19-6-11-26-12-7-19)25(27-24)21-4-2-18(3-5-21)22-10-15-29-17-22;1-28-12-8-16(9-13-28)20-14-19(15-6-10-26-11-7-15)21(27-20)17-2-4-18(5-3-17)22(23,24)25;1-15-14-26(2)12-9-19(15)21-13-20(16-7-10-24-11-8-16)22(25-21)17-3-5-18(23)6-4-17;1-15-13-18(9-12-26(15)2)21-14-20(16-7-10-24-11-8-16)22(25-21)17-3-5-19(23)6-4-17;1-25-13-9-17(10-14-25)21-15-20(16-7-11-23-12-8-16)22(24-21)18-3-5-19(26-2)6-4-18/h2-7,10-12,15-17,20,27H,8-9,13-14H2,1H3;2-7,10-11,14,16,27H,8-9,12-13H2,1H3;3-8,10-11,13,15,19,25H,9,12,14H2,1-2H3;3-8,10-11,14-15,18,25H,9,12-13H2,1-2H3;3-8,11-12,15,17,24H,9-10,13-14H2,1-2H3
InChIKeySFOKAZOIKAZFFO-UHFFFAOYSA-N
XLogP26.43
TPSA168.83 Ų
H-Bond Donors5
H-Bond Acceptors12
Rotatable Bonds17
Heavy Atoms135
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001831.36
LogP ≤ 526.43
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1012

Analyze 4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine with MolForge

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Related Compounds

2-Benzyl-1-propan-2-ylpyrrolidine;3-benzyl-1-propan-2-ylpyrrolidine;4-tert-butyl-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;4-ethoxy-1-propan-2-ylpiperidine;4-methoxy-1-propan-2-ylpiperidine;2-methyl-1-propan-2-ylpiperidine;2-(phenoxymethyl)-1-propan-2-ylpyrrolidine;2-phenyl-1-propan-2-ylpyrrolidine;3-phenyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpyrrolidin-2-yl)pyridine;3-(1-propan-2-ylpyrrolidin-2-yl)pyridine;4-(1-propan-2-ylpyrrolidin-2-yl)pyridine;1-propan-2-yl-2-thiophen-2-ylpyrrolidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;2,4,4-trimethyl-1-propan-2-ylpyrrolidine
CID 160052929
2-Benzyl-1-propan-2-ylpyrrolidine;3-benzyl-1-propan-2-ylpyrrolidine;4-tert-butyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;4-ethoxy-1-propan-2-ylpiperidine;2-(4-fluorophenyl)-1-propan-2-ylpyrrolidine;3-(4-fluorophenyl)-1-propan-2-ylpyrrolidine;4-methoxy-1-propan-2-ylpiperidine;2-methyl-1-propan-2-ylpiperidine;3-methyl-1-propan-2-ylpiperidine;2-(phenoxymethyl)-1-propan-2-ylpyrrolidine;2-phenyl-1-propan-2-ylpyrrolidine;3-phenyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidin-3-ol;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpyrrolidin-2-yl)pyridine;3-(1-propan-2-ylpyrrolidin-2-yl)pyridine;4-(1-propan-2-ylpyrrolidin-2-yl)pyridine;1-propan-2-yl-2-thiophen-2-ylpyrrolidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;2,3,3-trimethyl-1-propan-2-ylpiperidine;2,4,4-trimethyl-1-propan-2-ylpyrrolidine
CID 160304752
2-Benzyl-1-propan-2-ylpyrrolidine;3-benzyl-1-propan-2-ylpyrrolidine;4-tert-butyl-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;4-ethoxy-1-propan-2-ylpiperidine;4-methoxy-1-propan-2-ylpiperidine;2-methyl-1-propan-2-ylpiperidine;2-(phenoxymethyl)-1-propan-2-ylpyrrolidine;2-phenyl-1-propan-2-ylpyrrolidine;3-phenyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpyrrolidin-2-yl)pyridine;3-(1-propan-2-ylpyrrolidin-2-yl)pyridine;4-(1-propan-2-ylpyrrolidin-2-yl)pyridine;1-propan-2-yl-2-thiophen-2-ylpyrrolidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;2,4,4-trimethyl-1-propan-2-ylpyrrolidine
CID 160961388
4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-[(3Z,5E)-5-fluorohepta-1,3,5-trien-2-yl]-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]-3-methylpyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine
CID 164976025
difluoro-[(2Z)-2-[[5-(4-methoxyphenyl)-1-methylpyrrol-2-yl]methylidene]-3,5-dimethyl-4-propylpyrrol-1-ium-1-yl]borane;difluoro-[2-[[1-methyl-5-[(1E,3E)-4-phenylbuta-1,3-dienyl]pyrrol-1-ium-2-ylidene]methyl]-5-propylpyrrol-1-yl]borane;difluoro-[2-[(1-methyl-5-phenylpyrrol-1-ium-2-ylidene)methyl]-5-propylpyrrol-1-yl]borane;difluoro-[(5Z)-2-propyl-5-[(1,3,5-trimethylpyrrol-2-yl)methylidene]pyrrol-1-ium-1-yl]borane;[2-[(E)-2-(4-ethoxyphenyl)ethenyl]-5-[[1-methyl-5-(1H-pyrrol-2-yl)pyrrol-1-ium-2-ylidene]methyl]pyrrol-1-yl]-difluoroborane;[2-[(E)-2-(4-ethoxyphenyl)ethenyl]-5-[(1-methyl-5-thiophen-2-ylpyrrol-1-ium-2-ylidene)methyl]pyrrol-1-yl]-difluoroborane;[(5Z)-2-(4-ethoxyphenyl)-5-[(1-methyl-5-phenylpyrrol-2-yl)methylidene]pyrrol-1-ium-1-yl]-difluoroborane
CID 159440589
2-[2-(1-benzothiophen-3-yl)ethyl]-7-ethyl-2-azabicyclo[2.2.2]oct-5-ene;3-[2-(7-benzyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-5-fluoro-1H-indole;3-[2-(7-benzyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-1H-indole;3-[2-(7-butyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-1H-indole;3-[2-(7-ethyl-7-methyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-4-fluoro-1H-indole;5-fluoro-3-[2-(7-propyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-1H-indole;3-[2-(7-methyl-7-propyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-1H-indole;3-[2-[7-(phenylmethoxymethyl)-2-azabicyclo[2.2.2]oct-5-en-2-yl]ethyl]-1H-indole
CID 159951570
2-Benzyl-1-propan-2-ylpiperidine;3-benzyl-1-propan-2-ylpiperidine;2-benzyl-1-propan-2-ylpyrrolidine;3-benzyl-1-propan-2-ylpyrrolidine;4-tert-butyl-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2-methyl-1-propan-2-ylpiperidine;2-(phenoxymethyl)-1-propan-2-ylpyrrolidine;2-phenyl-1-propan-2-ylpiperidine;3-phenyl-1-propan-2-ylpiperidine;4-phenyl-1-propan-2-ylpiperidine;2-phenyl-1-propan-2-ylpyrrolidine;2-(1-propan-2-ylpyrrolidin-2-yl)pyridine;3-(1-propan-2-ylpyrrolidin-2-yl)pyridine;1-propan-2-yl-2-thiophen-2-ylpyrrolidine
CID 160016126
2-[2-(1-benzothiophen-3-yl)ethyl]-7-ethyl-2-azabicyclo[2.2.2]oct-5-ene;3-[2-(7-benzyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-5-fluoro-1H-indole;3-[2-(7-benzyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-1H-indole;3-[2-(7-butyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-1H-indole;5-fluoro-3-[2-(7-propyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-1H-indole;3-[2-(7-methyl-7-propyl-2-azabicyclo[2.2.2]oct-5-en-2-yl)ethyl]-1H-indole;3-[2-[7-(phenylmethoxymethyl)-2-azabicyclo[2.2.2]oct-5-en-2-yl]ethyl]-1H-indole
CID 160748797
9-methoxy-6-methyl-6H-pyrido[2,1-a]isoindol-5-ium;6-methyl-9-(6-methyl-1-benzothiophen-2-yl)-6H-pyrido[2,1-a]isoindol-5-ium;6-methyl-9-(4-methylnaphthalen-1-yl)-6H-pyrido[2,1-a]isoindol-5-ium;6-methyl-9-(6-methylnaphthalen-2-yl)-6H-pyrido[2,1-a]isoindol-5-ium;6-methyl-9-(5-methylthiophen-2-yl)-6H-pyrido[2,1-a]isoindol-5-ium
CID 160997543

Frequently Asked Questions

What is the IUPAC name of 4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine?
The IUPAC name of 4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine (CID 165067612) is 4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine.
What is the SMILES notation for 4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine?
The canonical SMILES for 4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine is CC1CC(c2cc(-c3ccncc3)c(-c3ccc(F)cc3)[nH]2)CCN1C.CC1CN(C)CCC1c1cc(-c2ccncc2)c(-c2ccc(F)cc2)[nH]1.CN1CCC(c2cc(-c3ccncc3)c(-c3ccc(-c4ccsc4)cc3)[nH]2)CC1.CN1CCC(c2cc(-c3ccncc3)c(-c3ccc(C(F)(F)F)cc3)[nH]2)CC1.COc1ccc(-c2[nH]c(C3CCN(C)CC3)cc2-c2ccncc2)cc1.
What is the InChIKey of 4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine?
The InChIKey is SFOKAZOIKAZFFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3S.C22H22F3N3.2C22H24FN3.C22H25N3O/c1-28-13-8-20(9-14-28)24-16-23(19-6-11-26-12-7-19)25(27-24)21-4-2-18(3-5-21)22-10-15-29-17-22;1-28-12-8-16(9-13-28)20-14-19(15-6-10-26-11-7-15)21(27-20)17-2-4-18(5-3-17)22(23,24)25;1-15-14-26(2)12-9-19(15)21-13-20(16-7-10-24-11-8-16)22(25-21)17-3-5-18(23)6-4-17;1-15-13-18(9-12-26(15)2)21-14-20(16-7-10-24-11-8-16)22(25-21)17-3-5-19(23)6-4-17;1-25-13-9-17(10-14-25)21-15-20(16-7-11-23-12-8-16)22(24-21)18-3-5-19(26-2)6-4-18/h2-7,10-12,15-17,20,27H,8-9,13-14H2,1H3;2-7,10-11,14,16,27H,8-9,12-13H2,1H3;3-8,10-11,13,15,19,25H,9,12,14H2,1-2H3;3-8,10-11,14-15,18,25H,9,12-13H2,1-2H3;3-8,11-12,15,17,24H,9-10,13-14H2,1-2H3.
What are the key properties of 4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine?
4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine has a molecular weight of 1831.36 g/mol, XLogP of 26.43, 17 rotatable bonds, 5 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(1,2-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1,3-dimethylpiperidin-4-yl)-2-(4-fluorophenyl)-1H-pyrrol-3-yl]pyridine;4-[2-(4-methoxyphenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-(4-thiophen-3-ylphenyl)-1H-pyrrol-3-yl]pyridine;4-[5-(1-methylpiperidin-4-yl)-2-[4-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]pyridine is sourced from PubChem (CID 165067612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).