(3-benzyl-2-ethylcyclopentyl)benzene

C20H24 — CID 165353387

IUPAC(3-benzyl-2-ethylcyclopentyl)benzene
SMILESCCC1C(Cc2ccccc2)CCC1c1ccccc1
InChIInChI=1S/C20H24/c1-2-19-18(15-16-9-5-3-6-10-16)13-14-20(19)17-11-7-4-8-12-17/h3-12,18-20H,2,13-15H2,1H3
InChIKeyWEWHQKKHNBOHSU-UHFFFAOYSA-N
MW264.41 g/mol
LogP5.45
Rot. Bonds4

About (3-benzyl-2-ethylcyclopentyl)benzene

(3-benzyl-2-ethylcyclopentyl)benzene (PubChem CID 165353387) has the molecular formula C20H24 and a molecular weight of 264.41 g/mol. Its IUPAC name is (3-benzyl-2-ethylcyclopentyl)benzene.

Molecular Properties

Compound Name(3-benzyl-2-ethylcyclopentyl)benzene
PubChem CID165353387
Molecular FormulaC20H24
Molecular Weight264.41 g/mol
Exact Mass264.19
IUPAC Name(3-benzyl-2-ethylcyclopentyl)benzene
SMILESCCC1C(Cc2ccccc2)CCC1c1ccccc1
InChIInChI=1S/C20H24/c1-2-19-18(15-16-9-5-3-6-10-16)13-14-20(19)17-11-7-4-8-12-17/h3-12,18-20H,2,13-15H2,1H3
InChIKeyWEWHQKKHNBOHSU-UHFFFAOYSA-N
XLogP5.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.41
LogP ≤ 55.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (3-benzyl-2-ethylcyclopentyl)benzene?
The IUPAC name of (3-benzyl-2-ethylcyclopentyl)benzene (CID 165353387) is (3-benzyl-2-ethylcyclopentyl)benzene.
What is the SMILES notation for (3-benzyl-2-ethylcyclopentyl)benzene?
The canonical SMILES for (3-benzyl-2-ethylcyclopentyl)benzene is CCC1C(Cc2ccccc2)CCC1c1ccccc1.
What is the InChIKey of (3-benzyl-2-ethylcyclopentyl)benzene?
The InChIKey is WEWHQKKHNBOHSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24/c1-2-19-18(15-16-9-5-3-6-10-16)13-14-20(19)17-11-7-4-8-12-17/h3-12,18-20H,2,13-15H2,1H3.
What are the key properties of (3-benzyl-2-ethylcyclopentyl)benzene?
(3-benzyl-2-ethylcyclopentyl)benzene has a molecular weight of 264.41 g/mol, XLogP of 5.45, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-benzyl-2-ethylcyclopentyl)benzene is sourced from PubChem (CID 165353387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).