1-ethyl-2,4-bis(1-phenylethyl)benzene

C24H26 — CID 3019817

IUPAC1-ethyl-2,4-bis(1-phenylethyl)benzene
SMILESCCc1ccc(C(C)c2ccccc2)cc1C(C)c1ccccc1
InChIInChI=1S/C24H26/c1-4-20-15-16-23(18(2)21-11-7-5-8-12-21)17-24(20)19(3)22-13-9-6-10-14-22/h5-19H,4H2,1-3H3
InChIKeyOYKXYXMSGIHYFD-UHFFFAOYSA-N
MW314.47 g/mol
LogP6.55
Rot. Bonds5

About 1-ethyl-2,4-bis(1-phenylethyl)benzene

1-ethyl-2,4-bis(1-phenylethyl)benzene (PubChem CID 3019817) has the molecular formula C24H26 and a molecular weight of 314.47 g/mol. Its IUPAC name is 1-ethyl-2,4-bis(1-phenylethyl)benzene.

Molecular Properties

Compound Name1-ethyl-2,4-bis(1-phenylethyl)benzene
PubChem CID3019817
Molecular FormulaC24H26
Molecular Weight314.47 g/mol
Exact Mass314.20
IUPAC Name1-ethyl-2,4-bis(1-phenylethyl)benzene
SMILESCCc1ccc(C(C)c2ccccc2)cc1C(C)c1ccccc1
InChIInChI=1S/C24H26/c1-4-20-15-16-23(18(2)21-11-7-5-8-12-21)17-24(20)19(3)22-13-9-6-10-14-22/h5-19H,4H2,1-3H3
InChIKeyOYKXYXMSGIHYFD-UHFFFAOYSA-N
XLogP6.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.47
LogP ≤ 56.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,4-bis(1-phenylethyl)benzene?
The IUPAC name of 1-ethyl-2,4-bis(1-phenylethyl)benzene (CID 3019817) is 1-ethyl-2,4-bis(1-phenylethyl)benzene.
What is the SMILES notation for 1-ethyl-2,4-bis(1-phenylethyl)benzene?
The canonical SMILES for 1-ethyl-2,4-bis(1-phenylethyl)benzene is CCc1ccc(C(C)c2ccccc2)cc1C(C)c1ccccc1.
What is the InChIKey of 1-ethyl-2,4-bis(1-phenylethyl)benzene?
The InChIKey is OYKXYXMSGIHYFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26/c1-4-20-15-16-23(18(2)21-11-7-5-8-12-21)17-24(20)19(3)22-13-9-6-10-14-22/h5-19H,4H2,1-3H3.
What are the key properties of 1-ethyl-2,4-bis(1-phenylethyl)benzene?
1-ethyl-2,4-bis(1-phenylethyl)benzene has a molecular weight of 314.47 g/mol, XLogP of 6.55, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,4-bis(1-phenylethyl)benzene is sourced from PubChem (CID 3019817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).