2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]

C112H122Cl6F3N13O9S6 — CID 164976546

About 2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]

2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine] (PubChem CID 164976546) has the molecular formula C112H122Cl6F3N13O9S6 and a molecular weight of 2256.40 g/mol. Its IUPAC name is 2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine].

Molecular Properties

• Compound Name: 2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]
• PubChem CID: 164976546
• Molecular Formula: C112H122Cl6F3N13O9S6
• Molecular Weight: 2256.40 g/mol
• Exact Mass: 2251.59
• IUPAC Name: 2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]
• SMILES: CC1CC2(CC(C3=NC=C(C(F)(F)F)C3)N1)OCCc1cc(Cl)sc12.CC1CC2(CC(c3[nH]nc4ccccc34)N1)OCCc1cc(Cl)sc12.CC1CC2(CC(c3cccc4cn[nH]c34)N1)OCCc1cc(Cl)sc12.COc1cccc(C2CC3(CC(C)N2)OCCc2cc(Cl)sc23)c1O.Cc1cccnc1C1CC2(CC(C)N1)OCCc1cc(Cl)sc12.Cc1nc2c(C3CC4(CC(C)N3)OCCc3cc(Cl)sc34)cccc2o1
• InChI: InChI=1S/C20H21ClN2O2S.2C19H20ClN3OS.C19H22ClNO3S.C18H21ClN2OS.C17H18ClF3N2OS/c1-11-9-20(19-13(6-7-24-20)8-17(21)26-19)10-15(22-11)14-4-3-5-16-18(14)23-12(2)25-16;1-11-8-19(18-12(5-6-24-19)7-16(20)25-18)9-15(22-11)14-4-2-3-13-10-21-23-17(13)14;1-11-9-19(18-12(6-7-24-19)8-16(20)25-18)10-15(21-11)17-13-4-2-3-5-14(13)22-23-17;1-11-9-19(18-12(6-7-24-19)8-16(20)25-18)10-14(21-11)13-4-3-5-15(23-2)17(13)22;1-11-4-3-6-20-16(11)14-10-18(9-12(2)21-14)17-13(5-7-22-18)8-15(19)23-17;1-9-6-16(15-10(2-3-24-16)4-14(18)25-15)7-13(23-9)12-5-11(8-22-12)17(19,20)21/h3-5,8,11,15,22H,6-7,9-10H2,1-2H3;2-4,7,10-11,15,22H,5-6,8-9H2,1H3,(H,21,23);2-5,8,11,15,21H,6-7,9-10H2,1H3,(H,22,23);3-5,8,11,14,21-22H,6-7,9-10H2,1-2H3;3-4,6,8,12,14,21H,5,7,9-10H2,1-2H3;4,8-9,13,23H,2-3,5-7H2,1H3
• InChIKey: DWFBKRNJLGADCO-UHFFFAOYSA-N
• XLogP: 27.63
• TPSA: 265.66 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 26
• Rotatable Bonds: 7
• Heavy Atoms: 149
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2256.40
LogP ≤ 5	27.63
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]?

The IUPAC name of 2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine] (CID 164976546) is 2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine].

What is the SMILES notation for 2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]?

The canonical SMILES for 2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine] is CC1CC2(CC(C3=NC=C(C(F)(F)F)C3)N1)OCCc1cc(Cl)sc12.CC1CC2(CC(c3[nH]nc4ccccc34)N1)OCCc1cc(Cl)sc12.CC1CC2(CC(c3cccc4cn[nH]c34)N1)OCCc1cc(Cl)sc12.COc1cccc(C2CC3(CC(C)N2)OCCc2cc(Cl)sc23)c1O.Cc1cccnc1C1CC2(CC(C)N1)OCCc1cc(Cl)sc12.Cc1nc2c(C3CC4(CC(C)N3)OCCc3cc(Cl)sc34)cccc2o1.

What is the InChIKey of 2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]?

The InChIKey is DWFBKRNJLGADCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21ClN2O2S.2C19H20ClN3OS.C19H22ClNO3S.C18H21ClN2OS.C17H18ClF3N2OS/c1-11-9-20(19-13(6-7-24-20)8-17(21)26-19)10-15(22-11)14-4-3-5-16-18(14)23-12(2)25-16;1-11-8-19(18-12(5-6-24-19)7-16(20)25-18)9-15(22-11)14-4-2-3-13-10-21-23-17(13)14;1-11-9-19(18-12(6-7-24-19)8-16(20)25-18)10-15(21-11)17-13-4-2-3-5-14(13)22-23-17;1-11-9-19(18-12(6-7-24-19)8-16(20)25-18)10-14(21-11)13-4-3-5-15(23-2)17(13)22;1-11-4-3-6-20-16(11)14-10-18(9-12(2)21-14)17-13(5-7-22-18)8-15(19)23-17;1-9-6-16(15-10(2-3-24-16)4-14(18)25-15)7-13(23-9)12-5-11(8-22-12)17(19,20)21/h3-5,8,11,15,22H,6-7,9-10H2,1-2H3;2-4,7,10-11,15,22H,5-6,8-9H2,1H3,(H,21,23);2-5,8,11,15,21H,6-7,9-10H2,1H3,(H,22,23);3-5,8,11,14,21-22H,6-7,9-10H2,1-2H3;3-4,6,8,12,14,21H,5,7,9-10H2,1-2H3;4,8-9,13,23H,2-3,5-7H2,1H3.

What are the key properties of 2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]?

2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine] has a molecular weight of 2256.40 g/mol, XLogP of 27.63, 7 rotatable bonds, 9 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-2'-(1H-indazol-7-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-(2H-indazol-3-yl)-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(2-methyl-1,3-benzoxazol-4-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-chloro-2'-methyl-6'-(3-methyl-2-pyridinyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine];2-(2-chloro-6'-methylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-2'-yl)-6-methoxyphenol;2-chloro-2'-methyl-6'-[4-(trifluoromethyl)-3H-pyrrol-2-yl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine] is sourced from PubChem (CID 164976546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).