bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate

C198H333N11O33 — CID 158947289

IUPACbis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate
SMILESCC1(C)CC(OC(=O)CC(C(=O)OC2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)C(=O)OC2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)CC(C)(C)N1OC1CCCCC1.CC1(C)CC(OC(=O)CCCCCCCCC(=O)OC2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)CC(C)(C)N1OC1CCCCC1.CC1(C)CC(OC(=O)c2cc(C(=O)OC3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)c(C(=O)OC3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)cc2C(=O)OC2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)CC(C)(C)N1OC1CCCCC1.CC1(C)CC(OC(=O)c2ccc(C(=O)OC3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)cc2)CC(C)(C)N1OC1CCCCC1
InChIInChI=1S/C70H114N4O12.C50H87N3O9.C40H72N2O6.C38H60N2O6/c1-63(2)39-51(40-64(3,4)71(63)83-47-29-21-17-22-30-47)79-59(75)55-37-57(61(77)81-53-43-67(9,10)73(68(11,12)44-53)85-49-33-25-19-26-34-49)58(62(78)82-54-45-69(13,14)74(70(15,16)46-54)86-50-35-27-20-28-36-50)38-56(55)60(76)80-52-41-65(5,6)72(66(7,8)42-52)84-48-31-23-18-24-32-48;1-45(2)29-38(30-46(3,4)51(45)60-35-22-16-13-17-23-35)57-42(54)28-41(43(55)58-39-31-47(5,6)52(48(7,8)32-39)61-36-24-18-14-19-25-36)44(56)59-40-33-49(9,10)53(50(11,12)34-40)62-37-26-20-15-21-27-37;1-37(2)27-33(28-38(3,4)41(37)47-31-21-15-13-16-22-31)45-35(43)25-19-11-9-10-12-20-26-36(44)46-34-29-39(5,6)42(40(7,8)30-34)48-32-23-17-14-18-24-32;1-35(2)23-31(24-36(3,4)39(35)45-29-15-11-9-12-16-29)43-33(41)27-19-21-28(22-20-27)34(42)44-32-25-37(5,6)40(38(7,8)26-32)46-30-17-13-10-14-18-30/h37-38,47-54H,17-36,39-46H2,1-16H3;35-41H,13-34H2,1-12H3;31-34H,9-30H2,1-8H3;19-22,29-32H,9-18,23-26H2,1-8H3
InChIKeyJKZCGGOSUWDVNY-UHFFFAOYSA-N
MW3395.89 g/mol
LogP44.27
Rot. Bonds52

About bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate

bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate (PubChem CID 158947289) has the molecular formula C198H333N11O33 and a molecular weight of 3395.89 g/mol. Its IUPAC name is bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate.

Molecular Properties

Compound Namebis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate
PubChem CID158947289
Molecular FormulaC198H333N11O33
Molecular Weight3395.89 g/mol
Exact Mass3393.47
IUPAC Namebis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate
SMILESCC1(C)CC(OC(=O)CC(C(=O)OC2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)C(=O)OC2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)CC(C)(C)N1OC1CCCCC1.CC1(C)CC(OC(=O)CCCCCCCCC(=O)OC2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)CC(C)(C)N1OC1CCCCC1.CC1(C)CC(OC(=O)c2cc(C(=O)OC3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)c(C(=O)OC3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)cc2C(=O)OC2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)CC(C)(C)N1OC1CCCCC1.CC1(C)CC(OC(=O)c2ccc(C(=O)OC3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)cc2)CC(C)(C)N1OC1CCCCC1
InChIInChI=1S/C70H114N4O12.C50H87N3O9.C40H72N2O6.C38H60N2O6/c1-63(2)39-51(40-64(3,4)71(63)83-47-29-21-17-22-30-47)79-59(75)55-37-57(61(77)81-53-43-67(9,10)73(68(11,12)44-53)85-49-33-25-19-26-34-49)58(62(78)82-54-45-69(13,14)74(70(15,16)46-54)86-50-35-27-20-28-36-50)38-56(55)60(76)80-52-41-65(5,6)72(66(7,8)42-52)84-48-31-23-18-24-32-48;1-45(2)29-38(30-46(3,4)51(45)60-35-22-16-13-17-23-35)57-42(54)28-41(43(55)58-39-31-47(5,6)52(48(7,8)32-39)61-36-24-18-14-19-25-36)44(56)59-40-33-49(9,10)53(50(11,12)34-40)62-37-26-20-15-21-27-37;1-37(2)27-33(28-38(3,4)41(37)47-31-21-15-13-16-22-31)45-35(43)25-19-11-9-10-12-20-26-36(44)46-34-29-39(5,6)42(40(7,8)30-34)48-32-23-17-14-18-24-32;1-35(2)23-31(24-36(3,4)39(35)45-29-15-11-9-12-16-29)43-33(41)27-19-21-28(22-20-27)34(42)44-32-25-37(5,6)40(38(7,8)26-32)46-30-17-13-10-14-18-30/h37-38,47-54H,17-36,39-46H2,1-16H3;35-41H,13-34H2,1-12H3;31-34H,9-30H2,1-8H3;19-22,29-32H,9-18,23-26H2,1-8H3
InChIKeyJKZCGGOSUWDVNY-UHFFFAOYSA-N
XLogP44.27
TPSA426.47 Ų
H-Bond Donors
H-Bond Acceptors44
Rotatable Bonds52
Heavy Atoms242
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003395.89
LogP ≤ 544.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1044

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Analyze bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate 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

1-O,2-O-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate
CID 90132227
(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) 4-(chloromethyl)benzoate
CID 54381320
(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) 3,5-ditert-butyl-4-hydroxybenzoate
CID 19892345
CID 169012650
CID 169012650
bis[1-[4-[1-(4-benzoyloxy-2,2,6,6-tetramethylpiperidin-1-yl)oxyethyl]phenyl]ethyl] decanedioate
CID 20771162
1-O,2-O-bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(2,2,6,6-tetramethyl-1-sulfanylpiperidin-4-yl) ethane-1,1,2-tricarboxylate
CID 145331536
1-O,2-O-bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(2,2,6,6-tetramethyl-1-oxidopiperidin-4-yl) ethane-1,1,2-tricarboxylate
CID 147915843
[1-[7-(4-benzoyloxy-2,2,6,6-tetramethylpiperidin-1-yl)oxyheptoxy]-2,2,6,6-tetramethylpiperidin-4-yl] benzoate
CID 57063329
bis(1,2,2,6,6-pentamethylpiperidin-4-yl) tridecanedioate
CID 162454117
bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) hexanedioate
CID 57039687
bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-ethylbutanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-methylbutanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-methyldecanedioate;1-hydroxy-4-[2-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxyethoxy]-2,2,6,6-tetramethylpiperidine;1-hydroxy-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidine;(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) benzoate;(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 4-methylbenzoate
CID 159515534
bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-ethylbutanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-methylbutanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-methyldecanedioate;1-hydroxy-4-[4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxybutoxy]-2,2,6,6-tetramethylpiperidine;1-hydroxy-4-[2-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxyethoxy]-2,2,6,6-tetramethylpiperidine;(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) benzoate;(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 4-methylbenzoate
CID 158964764

Frequently Asked Questions

What is the IUPAC name of bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate?
The IUPAC name of bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate (CID 158947289) is bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate.
What is the SMILES notation for bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate?
The canonical SMILES for bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate is CC1(C)CC(OC(=O)CC(C(=O)OC2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)C(=O)OC2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)CC(C)(C)N1OC1CCCCC1.CC1(C)CC(OC(=O)CCCCCCCCC(=O)OC2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)CC(C)(C)N1OC1CCCCC1.CC1(C)CC(OC(=O)c2cc(C(=O)OC3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)c(C(=O)OC3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)cc2C(=O)OC2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)CC(C)(C)N1OC1CCCCC1.CC1(C)CC(OC(=O)c2ccc(C(=O)OC3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)cc2)CC(C)(C)N1OC1CCCCC1.
What is the InChIKey of bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate?
The InChIKey is JKZCGGOSUWDVNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H114N4O12.C50H87N3O9.C40H72N2O6.C38H60N2O6/c1-63(2)39-51(40-64(3,4)71(63)83-47-29-21-17-22-30-47)79-59(75)55-37-57(61(77)81-53-43-67(9,10)73(68(11,12)44-53)85-49-33-25-19-26-34-49)58(62(78)82-54-45-69(13,14)74(70(15,16)46-54)86-50-35-27-20-28-36-50)38-56(55)60(76)80-52-41-65(5,6)72(66(7,8)42-52)84-48-31-23-18-24-32-48;1-45(2)29-38(30-46(3,4)51(45)60-35-22-16-13-17-23-35)57-42(54)28-41(43(55)58-39-31-47(5,6)52(48(7,8)32-39)61-36-24-18-14-19-25-36)44(56)59-40-33-49(9,10)53(50(11,12)34-40)62-37-26-20-15-21-27-37;1-37(2)27-33(28-38(3,4)41(37)47-31-21-15-13-16-22-31)45-35(43)25-19-11-9-10-12-20-26-36(44)46-34-29-39(5,6)42(40(7,8)30-34)48-32-23-17-14-18-24-32;1-35(2)23-31(24-36(3,4)39(35)45-29-15-11-9-12-16-29)43-33(41)27-19-21-28(22-20-27)34(42)44-32-25-37(5,6)40(38(7,8)26-32)46-30-17-13-10-14-18-30/h37-38,47-54H,17-36,39-46H2,1-16H3;35-41H,13-34H2,1-12H3;31-34H,9-30H2,1-8H3;19-22,29-32H,9-18,23-26H2,1-8H3.
What are the key properties of bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate?
bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate has a molecular weight of 3395.89 g/mol, XLogP of 44.27, 52 rotatable bonds, 0 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,4-dicarboxylate;bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;tetrakis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) benzene-1,2,4,5-tetracarboxylate;tris(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl) ethane-1,1,2-tricarboxylate is sourced from PubChem (CID 158947289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).