2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene

C36H30 — CID 174141308

IUPAC2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene
SMILESCCc1cc(CC)cc(-c2ccc3cc(-c4ccc(-c5cccc6ccccc56)cc4)ccc3c2)c1
InChIInChI=1S/C36H30/c1-3-25-20-26(4-2)22-34(21-25)33-19-18-31-23-30(16-17-32(31)24-33)27-12-14-29(15-13-27)36-11-7-9-28-8-5-6-10-35(28)36/h5-24H,3-4H2,1-2H3
InChIKeyUUTMVVGIBRZUJF-UHFFFAOYSA-N
MW462.64 g/mol
LogP10.12
Rot. Bonds5

About 2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene

2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene (PubChem CID 174141308) has the molecular formula C36H30 and a molecular weight of 462.64 g/mol. Its IUPAC name is 2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene.

Molecular Properties

Compound Name2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene
PubChem CID174141308
Molecular FormulaC36H30
Molecular Weight462.64 g/mol
Exact Mass462.23
IUPAC Name2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene
SMILESCCc1cc(CC)cc(-c2ccc3cc(-c4ccc(-c5cccc6ccccc56)cc4)ccc3c2)c1
InChIInChI=1S/C36H30/c1-3-25-20-26(4-2)22-34(21-25)33-19-18-31-23-30(16-17-32(31)24-33)27-12-14-29(15-13-27)36-11-7-9-28-8-5-6-10-35(28)36/h5-24H,3-4H2,1-2H3
InChIKeyUUTMVVGIBRZUJF-UHFFFAOYSA-N
XLogP10.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500462.64
LogP ≤ 510.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene
CID 168844837
1-[3-naphthalen-2-yl-5-[4-[4-(3-naphthalen-1-yl-5-naphthalen-2-ylphenyl)phenyl]phenyl]phenyl]naphthalene
CID 18710973
1,3-diphenylbenzene;ethane;1-phenylnaphthalene;2-phenylnaphthalene
CID 157179117
ethane;1-(4-ethylphenyl)naphthalene
CID 143262541
1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene
CID 145347928
1-[4-[3-(4-naphthalen-1-ylphenyl)phenyl]phenyl]naphthalene
CID 10983707
1-(3-naphthalen-2-ylphenyl)naphthalene
CID 153293143
9-(3-naphthalen-2-ylphenyl)-10-[6-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene
CID 123921245
9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]anthracene
CID 160960650
2-[3,5-bis(trifluoromethyl)phenyl]-6-(4-naphthalen-1-ylphenyl)naphthalene
CID 169293839
2-naphthalen-1-ylanthracene
CID 2748705
4-methyl-N-[4-[2-[4-(4-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]anilino)phenyl]ethyl]phenyl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]aniline
CID 155377469

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene?
The IUPAC name of 2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene (CID 174141308) is 2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene.
What is the SMILES notation for 2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene?
The canonical SMILES for 2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene is CCc1cc(CC)cc(-c2ccc3cc(-c4ccc(-c5cccc6ccccc56)cc4)ccc3c2)c1.
What is the InChIKey of 2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene?
The InChIKey is UUTMVVGIBRZUJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H30/c1-3-25-20-26(4-2)22-34(21-25)33-19-18-31-23-30(16-17-32(31)24-33)27-12-14-29(15-13-27)36-11-7-9-28-8-5-6-10-35(28)36/h5-24H,3-4H2,1-2H3.
What are the key properties of 2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene?
2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene has a molecular weight of 462.64 g/mol, XLogP of 10.12, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene is sourced from PubChem (CID 174141308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).