2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene

C89H84 — CID 162121988

IUPAC2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene
SMILESCC(C)(C)c1c(-c2ccc3ccccc3c2)cccc1-c1ccc2ccccc2c1.CC(C)c1c(-c2ccccc2)c(-c2ccccc2)cc(-c2ccccc2)c1-c1ccccc1.Cc1ccc(-c2cccc(-c3ccc(C(C)(C)C)cc3)c2C(C)C)cc1
InChIInChI=1S/C33H28.C30H26.C26H30/c1-24(2)31-32(27-19-11-5-12-20-27)29(25-15-7-3-8-16-25)23-30(26-17-9-4-10-18-26)33(31)28-21-13-6-14-22-28;1-30(2,3)29-27(25-17-15-21-9-4-6-11-23(21)19-25)13-8-14-28(29)26-18-16-22-10-5-7-12-24(22)20-26;1-18(2)25-23(20-12-10-19(3)11-13-20)8-7-9-24(25)21-14-16-22(17-15-21)26(4,5)6/h3-24H,1-2H3;4-20H,1-3H3;7-18H,1-6H3
InChIKeyZHNMMKBKGZCOHE-UHFFFAOYSA-N
MW1153.65 g/mol
LogP25.85
Rot. Bonds10

About 2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene

2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene (PubChem CID 162121988) has the molecular formula C89H84 and a molecular weight of 1153.65 g/mol. Its IUPAC name is 2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene.

Molecular Properties

Compound Name2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene
PubChem CID162121988
Molecular FormulaC89H84
Molecular Weight1153.65 g/mol
Exact Mass1152.66
IUPAC Name2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene
SMILESCC(C)(C)c1c(-c2ccc3ccccc3c2)cccc1-c1ccc2ccccc2c1.CC(C)c1c(-c2ccccc2)c(-c2ccccc2)cc(-c2ccccc2)c1-c1ccccc1.Cc1ccc(-c2cccc(-c3ccc(C(C)(C)C)cc3)c2C(C)C)cc1
InChIInChI=1S/C33H28.C30H26.C26H30/c1-24(2)31-32(27-19-11-5-12-20-27)29(25-15-7-3-8-16-25)23-30(26-17-9-4-10-18-26)33(31)28-21-13-6-14-22-28;1-30(2,3)29-27(25-17-15-21-9-4-6-11-23(21)19-25)13-8-14-28(29)26-18-16-22-10-5-7-12-24(22)20-26;1-18(2)25-23(20-12-10-19(3)11-13-20)8-7-9-24(25)21-14-16-22(17-15-21)26(4,5)6/h3-24H,1-2H3;4-20H,1-3H3;7-18H,1-6H3
InChIKeyZHNMMKBKGZCOHE-UHFFFAOYSA-N
XLogP25.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms89
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001153.65
LogP ≤ 525.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene 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

2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene
CID 123434342
2-tert-butyl-9,10-bis(4-phenylphenyl)anthracene;2-methyl-9,10-bis(4-phenylphenyl)anthracene;2-naphthalen-1-yl-9,10-bis(4-phenylphenyl)anthracene;2-naphthalen-2-yl-9,10-bis(4-phenylphenyl)anthracene;2-phenyl-9,10-bis(4-phenylphenyl)anthracene
CID 158638548
2,6-ditert-butyl-9-(4-naphthalen-2-ylphenyl)-10-(2-phenylphenyl)anthracene
CID 58830813
2-[2-(4-tert-butylphenyl)phenyl]-9,10-bis(3-naphthalen-2-ylphenyl)anthracene
CID 23154901
2-tert-butylnaphthalene;1-tert-butyl-4-phenylbenzene
CID 159502457
9-tert-butyl-10-naphthalen-2-yl-2-(4-naphthalen-1-ylnaphthalen-1-yl)anthracene;9-tert-butyl-10-naphthalen-2-yl-2-(4-phenanthren-9-ylnaphthalen-1-yl)anthracene;9-tert-butyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)anthracene
CID 161108763
2-tert-butyl-9-naphthalen-2-yl-10-[2-[3-(3-phenylphenyl)phenyl]phenyl]anthracene
CID 58965769
6-tert-butyl-1-(2,3,4,5-tetraphenylphenyl)azulene
CID 12023823
N-(4-tert-butylphenyl)-2,3-dinaphthalen-2-yl-N-phenylaniline
CID 177097061
9-(4-tert-butylphenyl)-10-[6-(3-phenylphenyl)naphthalen-2-yl]anthracene
CID 58590190
5,16-bis(4-tert-butylphenyl)-8,8,13,13-tetramethyl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene;8,8,13,13-tetramethyl-5,16-bis(3-methylphenyl)-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene;8,8,13,13-tetramethyl-5,16-bis(4-methylphenyl)-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene;8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene;8,8,13,13-tetramethyl-5,16-dinaphthalen-2-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene;8,8,13,13-tetramethyl-5,16-diphenyl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene
CID 159078124
9-tert-butyl-10-naphthalen-1-yl-2-(4-phenylnaphthalen-1-yl)anthracene
CID 123978082

Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene?
The IUPAC name of 2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene (CID 162121988) is 2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene.
What is the SMILES notation for 2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene?
The canonical SMILES for 2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene is CC(C)(C)c1c(-c2ccc3ccccc3c2)cccc1-c1ccc2ccccc2c1.CC(C)c1c(-c2ccccc2)c(-c2ccccc2)cc(-c2ccccc2)c1-c1ccccc1.Cc1ccc(-c2cccc(-c3ccc(C(C)(C)C)cc3)c2C(C)C)cc1.
What is the InChIKey of 2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene?
The InChIKey is ZHNMMKBKGZCOHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H28.C30H26.C26H30/c1-24(2)31-32(27-19-11-5-12-20-27)29(25-15-7-3-8-16-25)23-30(26-17-9-4-10-18-26)33(31)28-21-13-6-14-22-28;1-30(2,3)29-27(25-17-15-21-9-4-6-11-23(21)19-25)13-8-14-28(29)26-18-16-22-10-5-7-12-24(22)20-26;1-18(2)25-23(20-12-10-19(3)11-13-20)8-7-9-24(25)21-14-16-22(17-15-21)26(4,5)6/h3-24H,1-2H3;4-20H,1-3H3;7-18H,1-6H3.
What are the key properties of 2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene?
2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene has a molecular weight of 1153.65 g/mol, XLogP of 25.85, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butyl-3-naphthalen-2-ylphenyl)naphthalene;1-(4-tert-butylphenyl)-3-(4-methylphenyl)-2-propan-2-ylbenzene;1,2,4,5-tetraphenyl-3-propan-2-ylbenzene is sourced from PubChem (CID 162121988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).