2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene

C23H24 — CID 144613218

IUPAC2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene
SMILESCCC(c1ccccc1)c1ccc(-c2ccccc2C)c(C)c1
InChIInChI=1S/C23H24/c1-4-21(19-11-6-5-7-12-19)20-14-15-23(18(3)16-20)22-13-9-8-10-17(22)2/h5-16,21H,4H2,1-3H3
InChIKeyXIKRFUUMRZCRIP-UHFFFAOYSA-N
MW300.44 g/mol
LogP6.51
Rot. Bonds4

About 2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene

2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene (PubChem CID 144613218) has the molecular formula C23H24 and a molecular weight of 300.44 g/mol. Its IUPAC name is 2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene.

Molecular Properties

Compound Name2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene
PubChem CID144613218
Molecular FormulaC23H24
Molecular Weight300.44 g/mol
Exact Mass300.19
IUPAC Name2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene
SMILESCCC(c1ccccc1)c1ccc(-c2ccccc2C)c(C)c1
InChIInChI=1S/C23H24/c1-4-21(19-11-6-5-7-12-19)20-14-15-23(18(3)16-20)22-13-9-8-10-17(22)2/h5-16,21H,4H2,1-3H3
InChIKeyXIKRFUUMRZCRIP-UHFFFAOYSA-N
XLogP6.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.44
LogP ≤ 56.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene?
The IUPAC name of 2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene (CID 144613218) is 2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene.
What is the SMILES notation for 2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene?
The canonical SMILES for 2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene is CCC(c1ccccc1)c1ccc(-c2ccccc2C)c(C)c1.
What is the InChIKey of 2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene?
The InChIKey is XIKRFUUMRZCRIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24/c1-4-21(19-11-6-5-7-12-19)20-14-15-23(18(3)16-20)22-13-9-8-10-17(22)2/h5-16,21H,4H2,1-3H3.
What are the key properties of 2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene?
2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene has a molecular weight of 300.44 g/mol, XLogP of 6.51, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-methylphenyl)-4-(1-phenylpropyl)benzene is sourced from PubChem (CID 144613218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).