5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine

C78H81F3N16O7S7 — CID 161021233

IUPAC5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1-c1cc(S(=O)(=O)c2ccccc2)cc(N2CCCCC2)n1.Nc1nc(C(F)(F)F)c(-c2cc(S(=O)(=O)c3ccccc3)cc(N3CCCCC3)n2)s1.Nc1ncc(-c2cc(Oc3ccccc3)cc(N3CCCCC3)n2)s1.Nc1ncc(-c2cc(S(=O)(=O)c3ccccc3)cc(N3CCCCC3)n2)s1
InChIInChI=1S/C20H19F3N4O2S2.C20H22N4O2S2.C19H20N4O2S2.C19H20N4OS/c21-20(22,23)18-17(30-19(24)26-18)15-11-14(31(28,29)13-7-3-1-4-8-13)12-16(25-15)27-9-5-2-6-10-27;1-14-19(27-20(21)22-14)17-12-16(28(25,26)15-8-4-2-5-9-15)13-18(23-17)24-10-6-3-7-11-24;20-19-21-13-17(26-19)16-11-15(27(24,25)14-7-3-1-4-8-14)12-18(22-16)23-9-5-2-6-10-23;20-19-21-13-17(25-19)16-11-15(24-14-7-3-1-4-8-14)12-18(22-16)23-9-5-2-6-10-23/h1,3-4,7-8,11-12H,2,5-6,9-10H2,(H2,24,26);2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3,(H2,21,22);1,3-4,7-8,11-13H,2,5-6,9-10H2,(H2,20,21);1,3-4,7-8,11-13H,2,5-6,9-10H2,(H2,20,21)
InChIKeyTYJZKRYPYBJTCF-UHFFFAOYSA-N
MW1636.07 g/mol
LogP16.73
Rot. Bonds16

About 5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine

5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine (PubChem CID 161021233) has the molecular formula C78H81F3N16O7S7 and a molecular weight of 1636.07 g/mol. Its IUPAC name is 5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine
PubChem CID161021233
Molecular FormulaC78H81F3N16O7S7
Molecular Weight1636.07 g/mol
Exact Mass1634.45
IUPAC Name5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1-c1cc(S(=O)(=O)c2ccccc2)cc(N2CCCCC2)n1.Nc1nc(C(F)(F)F)c(-c2cc(S(=O)(=O)c3ccccc3)cc(N3CCCCC3)n2)s1.Nc1ncc(-c2cc(Oc3ccccc3)cc(N3CCCCC3)n2)s1.Nc1ncc(-c2cc(S(=O)(=O)c3ccccc3)cc(N3CCCCC3)n2)s1
InChIInChI=1S/C20H19F3N4O2S2.C20H22N4O2S2.C19H20N4O2S2.C19H20N4OS/c21-20(22,23)18-17(30-19(24)26-18)15-11-14(31(28,29)13-7-3-1-4-8-13)12-16(25-15)27-9-5-2-6-10-27;1-14-19(27-20(21)22-14)17-12-16(28(25,26)15-8-4-2-5-9-15)13-18(23-17)24-10-6-3-7-11-24;20-19-21-13-17(26-19)16-11-15(27(24,25)14-7-3-1-4-8-14)12-18(22-16)23-9-5-2-6-10-23;20-19-21-13-17(25-19)16-11-15(24-14-7-3-1-4-8-14)12-18(22-16)23-9-5-2-6-10-23/h1,3-4,7-8,11-12H,2,5-6,9-10H2,(H2,24,26);2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3,(H2,21,22);1,3-4,7-8,11-13H,2,5-6,9-10H2,(H2,20,21);1,3-4,7-8,11-13H,2,5-6,9-10H2,(H2,20,21)
InChIKeyTYJZKRYPYBJTCF-UHFFFAOYSA-N
XLogP16.73
TPSA331.81 Ų
H-Bond Donors4
H-Bond Acceptors27
Rotatable Bonds16
Heavy Atoms111
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001636.07
LogP ≤ 516.73
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1027

Analyze 5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine with MolForge

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Related Compounds

5-[4-(Benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine
CID 158757782
4-[3-(Benzenesulfonyl)-5-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]morpholine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine
CID 159712114
5-[4-[3-[4-[6-(2-Amino-1,3-thiazol-5-yl)-4-phenoxy-2-pyridinyl]morpholin-2-yl]phenyl]sulfonyl-6-morpholin-4-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine
CID 146181380

Frequently Asked Questions

What is the IUPAC name of 5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine (CID 161021233) is 5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine is Cc1nc(N)sc1-c1cc(S(=O)(=O)c2ccccc2)cc(N2CCCCC2)n1.Nc1nc(C(F)(F)F)c(-c2cc(S(=O)(=O)c3ccccc3)cc(N3CCCCC3)n2)s1.Nc1ncc(-c2cc(Oc3ccccc3)cc(N3CCCCC3)n2)s1.Nc1ncc(-c2cc(S(=O)(=O)c3ccccc3)cc(N3CCCCC3)n2)s1.
What is the InChIKey of 5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine?
The InChIKey is TYJZKRYPYBJTCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19F3N4O2S2.C20H22N4O2S2.C19H20N4O2S2.C19H20N4OS/c21-20(22,23)18-17(30-19(24)26-18)15-11-14(31(28,29)13-7-3-1-4-8-13)12-16(25-15)27-9-5-2-6-10-27;1-14-19(27-20(21)22-14)17-12-16(28(25,26)15-8-4-2-5-9-15)13-18(23-17)24-10-6-3-7-11-24;20-19-21-13-17(26-19)16-11-15(27(24,25)14-7-3-1-4-8-14)12-18(22-16)23-9-5-2-6-10-23;20-19-21-13-17(25-19)16-11-15(24-14-7-3-1-4-8-14)12-18(22-16)23-9-5-2-6-10-23/h1,3-4,7-8,11-12H,2,5-6,9-10H2,(H2,24,26);2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3,(H2,21,22);1,3-4,7-8,11-13H,2,5-6,9-10H2,(H2,20,21);1,3-4,7-8,11-13H,2,5-6,9-10H2,(H2,20,21).
What are the key properties of 5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine?
5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine has a molecular weight of 1636.07 g/mol, XLogP of 16.73, 16 rotatable bonds, 4 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-methyl-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-1,3-thiazol-2-amine;5-[4-(benzenesulfonyl)-6-piperidin-1-yl-2-pyridinyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine;5-(4-phenoxy-6-piperidin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 161021233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).