1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline

C143H201NO31 — CID 160893044

IUPAC1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline
SMILESCOCCOCCCc1cc(C)c2ccc3c(CCCOCCOC)cc(C)c4ccc1c2c43.COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCc1ccc2c(C)c3ccc(COCCOC)cc3c(C)c2c1.COCCOCCOCCOCCOCCc1ccc2c(C)c3ccc(CCOCCOC)cc3c(C)c2c1.COCCOc1cc(C)c(OCCOC)cc1C.COCCOc1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1
InChIInChI=1S/C44H70O14.C32H46O7.C30H38O4.C23H25NO2.C14H22O4/c1-37-41-7-5-39(35-57-12-10-46-4)33-43(41)38(2)44-34-40(6-8-42(37)44)36-58-32-31-56-30-29-55-28-27-54-26-25-53-24-23-52-22-21-51-20-19-50-18-17-49-16-15-48-14-13-47-11-9-45-3;1-25-29-7-5-27(9-11-35-15-13-33-3)23-31(29)26(2)32-24-28(6-8-30(25)32)10-12-36-17-18-38-21-22-39-20-19-37-16-14-34-4;1-21-19-23(7-5-13-33-17-15-31-3)27-12-10-26-22(2)20-24(8-6-14-34-18-16-32-4)28-11-9-25(21)29(27)30(26)28;1-18-4-8-20(9-5-18)24(21-10-6-19(2)7-11-21)22-12-14-23(15-13-22)26-17-16-25-3;1-11-9-14(18-8-6-16-4)12(2)10-13(11)17-7-5-15-3/h5-8,33-34H,9-32,35-36H2,1-4H3;5-8,23-24H,9-22H2,1-4H3;9-12,19-20H,5-8,13-18H2,1-4H3;4-15H,16-17H2,1-3H3;9-10H,5-8H2,1-4H3
InChIKeySONHLZCRRDQUCA-UHFFFAOYSA-N
MW2430.16 g/mol
LogP24.72
Rot. Bonds90

About 1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline

1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline (PubChem CID 160893044) has the molecular formula C143H201NO31 and a molecular weight of 2430.16 g/mol. Its IUPAC name is 1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline.

Molecular Properties

Compound Name1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline
PubChem CID160893044
Molecular FormulaC143H201NO31
Molecular Weight2430.16 g/mol
Exact Mass2428.42
IUPAC Name1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline
SMILESCOCCOCCCc1cc(C)c2ccc3c(CCCOCCOC)cc(C)c4ccc1c2c43.COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCc1ccc2c(C)c3ccc(COCCOC)cc3c(C)c2c1.COCCOCCOCCOCCOCCc1ccc2c(C)c3ccc(CCOCCOC)cc3c(C)c2c1.COCCOc1cc(C)c(OCCOC)cc1C.COCCOc1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1
InChIInChI=1S/C44H70O14.C32H46O7.C30H38O4.C23H25NO2.C14H22O4/c1-37-41-7-5-39(35-57-12-10-46-4)33-43(41)38(2)44-34-40(6-8-42(37)44)36-58-32-31-56-30-29-55-28-27-54-26-25-53-24-23-52-22-21-51-20-19-50-18-17-49-16-15-48-14-13-47-11-9-45-3;1-25-29-7-5-27(9-11-35-15-13-33-3)23-31(29)26(2)32-24-28(6-8-30(25)32)10-12-36-17-18-38-21-22-39-20-19-37-16-14-34-4;1-21-19-23(7-5-13-33-17-15-31-3)27-12-10-26-22(2)20-24(8-6-14-34-18-16-32-4)28-11-9-25(21)29(27)30(26)28;1-18-4-8-20(9-5-18)24(21-10-6-19(2)7-11-21)22-12-14-23(15-13-22)26-17-16-25-3;1-11-9-14(18-8-6-16-4)12(2)10-13(11)17-7-5-15-3/h5-8,33-34H,9-32,35-36H2,1-4H3;5-8,23-24H,9-22H2,1-4H3;9-12,19-20H,5-8,13-18H2,1-4H3;4-15H,16-17H2,1-3H3;9-10H,5-8H2,1-4H3
InChIKeySONHLZCRRDQUCA-UHFFFAOYSA-N
XLogP24.72
TPSA289.37 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds90
Heavy Atoms175
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002430.16
LogP ≤ 524.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline?
The IUPAC name of 1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline (CID 160893044) is 1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline.
What is the SMILES notation for 1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline?
The canonical SMILES for 1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline is COCCOCCCc1cc(C)c2ccc3c(CCCOCCOC)cc(C)c4ccc1c2c43.COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCc1ccc2c(C)c3ccc(COCCOC)cc3c(C)c2c1.COCCOCCOCCOCCOCCc1ccc2c(C)c3ccc(CCOCCOC)cc3c(C)c2c1.COCCOc1cc(C)c(OCCOC)cc1C.COCCOc1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1.
What is the InChIKey of 1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline?
The InChIKey is SONHLZCRRDQUCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H70O14.C32H46O7.C30H38O4.C23H25NO2.C14H22O4/c1-37-41-7-5-39(35-57-12-10-46-4)33-43(41)38(2)44-34-40(6-8-42(37)44)36-58-32-31-56-30-29-55-28-27-54-26-25-53-24-23-52-22-21-51-20-19-50-18-17-49-16-15-48-14-13-47-11-9-45-3;1-25-29-7-5-27(9-11-35-15-13-33-3)23-31(29)26(2)32-24-28(6-8-30(25)32)10-12-36-17-18-38-21-22-39-20-19-37-16-14-34-4;1-21-19-23(7-5-13-33-17-15-31-3)27-12-10-26-22(2)20-24(8-6-14-34-18-16-32-4)28-11-9-25(21)29(27)30(26)28;1-18-4-8-20(9-5-18)24(21-10-6-19(2)7-11-21)22-12-14-23(15-13-22)26-17-16-25-3;1-11-9-14(18-8-6-16-4)12(2)10-13(11)17-7-5-15-3/h5-8,33-34H,9-32,35-36H2,1-4H3;5-8,23-24H,9-22H2,1-4H3;9-12,19-20H,5-8,13-18H2,1-4H3;4-15H,16-17H2,1-3H3;9-10H,5-8H2,1-4H3.
What are the key properties of 1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline?
1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline has a molecular weight of 2430.16 g/mol, XLogP of 24.72, 90 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-bis(2-methoxyethoxy)-2,5-dimethylbenzene;1,6-bis[3-(2-methoxyethoxy)propyl]-3,8-dimethylpyrene;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-7-(2-methoxyethoxymethyl)-9,10-dimethylanthracene;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]-7-[2-(2-methoxyethoxy)ethyl]-9,10-dimethylanthracene;N-[4-(2-methoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline is sourced from PubChem (CID 160893044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).