2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene

C26H24 — CID 123434342

IUPAC2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene
SMILESCc1ccc2cc(-c3cccc(C(C)C)c3-c3ccccc3)ccc2c1
InChIInChI=1S/C26H24/c1-18(2)24-10-7-11-25(26(24)20-8-5-4-6-9-20)23-15-14-21-16-19(3)12-13-22(21)17-23/h4-18H,1-3H3
InChIKeyWCUDJKVHFVKHRV-UHFFFAOYSA-N
MW336.48 g/mol
LogP7.61
Rot. Bonds3

About 2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene

2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene (PubChem CID 123434342) has the molecular formula C26H24 and a molecular weight of 336.48 g/mol. Its IUPAC name is 2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene.

Molecular Properties

Compound Name2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene
PubChem CID123434342
Molecular FormulaC26H24
Molecular Weight336.48 g/mol
Exact Mass336.19
IUPAC Name2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene
SMILESCc1ccc2cc(-c3cccc(C(C)C)c3-c3ccccc3)ccc2c1
InChIInChI=1S/C26H24/c1-18(2)24-10-7-11-25(26(24)20-8-5-4-6-9-20)23-15-14-21-16-19(3)12-13-22(21)17-23/h4-18H,1-3H3
InChIKeyWCUDJKVHFVKHRV-UHFFFAOYSA-N
XLogP7.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.48
LogP ≤ 57.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene?
The IUPAC name of 2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene (CID 123434342) is 2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene.
What is the SMILES notation for 2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene?
The canonical SMILES for 2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene is Cc1ccc2cc(-c3cccc(C(C)C)c3-c3ccccc3)ccc2c1.
What is the InChIKey of 2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene?
The InChIKey is WCUDJKVHFVKHRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24/c1-18(2)24-10-7-11-25(26(24)20-8-5-4-6-9-20)23-15-14-21-16-19(3)12-13-22(21)17-23/h4-18H,1-3H3.
What are the key properties of 2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene?
2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene has a molecular weight of 336.48 g/mol, XLogP of 7.61, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene is sourced from PubChem (CID 123434342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).