[1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene

C24H28 — CID 140630327

IUPAC[1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene
SMILESCCCCC(C1=C(CC)C=CC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H28/c1-3-5-19-24(21-14-8-6-9-15-21,22-16-10-7-11-17-22)23-18-12-13-20(23)4-2/h6-17H,3-5,18-19H2,1-2H3
InChIKeyKYVNFBYHBUZFLT-UHFFFAOYSA-N
MW316.49 g/mol
LogP6.83
Rot. Bonds7

About [1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene

[1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene (PubChem CID 140630327) has the molecular formula C24H28 and a molecular weight of 316.49 g/mol. Its IUPAC name is [1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene.

Molecular Properties

Compound Name[1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene
PubChem CID140630327
Molecular FormulaC24H28
Molecular Weight316.49 g/mol
Exact Mass316.22
IUPAC Name[1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene
SMILESCCCCC(C1=C(CC)C=CC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H28/c1-3-5-19-24(21-14-8-6-9-15-21,22-16-10-7-11-17-22)23-18-12-13-20(23)4-2/h6-17H,3-5,18-19H2,1-2H3
InChIKeyKYVNFBYHBUZFLT-UHFFFAOYSA-N
XLogP6.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.49
LogP ≤ 56.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

[1-(2-tert-butylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene
CID 140629994
4-[1-phenyl-1-(4-sulfanylphenyl)pentyl]benzenethiol
CID 156622039
1-chloro-4-[1-(4-chlorophenyl)-1-phenylpentyl]benzene
CID 57254584
5-butylhexadecan-5-ylbenzene
CID 173084700
1,1-diphenylpentan-1-amine
CID 10263654
[1-(3-tert-butylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene
CID 140629842
(2-ethylcyclopenta-1,3-dien-1-yl)benzene
CID 139667599
2-butyl-2-phenylpropane-1,3-diol
CID 79449681
(5,6-diethyl-6-phenyldecan-5-yl)benzene
CID 10545838
5-phenyltetradecan-5-ol
CID 175223116
tributyl(4,4,4-triphenylbutyl)azanium
CID 118467118
5-phenylundecan-5-ol
CID 175525363

Frequently Asked Questions

What is the IUPAC name of [1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene?
The IUPAC name of [1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene (CID 140630327) is [1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene.
What is the SMILES notation for [1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene?
The canonical SMILES for [1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene is CCCCC(C1=C(CC)C=CC1)(c1ccccc1)c1ccccc1.
What is the InChIKey of [1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene?
The InChIKey is KYVNFBYHBUZFLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28/c1-3-5-19-24(21-14-8-6-9-15-21,22-16-10-7-11-17-22)23-18-12-13-20(23)4-2/h6-17H,3-5,18-19H2,1-2H3.
What are the key properties of [1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene?
[1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene has a molecular weight of 316.49 g/mol, XLogP of 6.83, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-ethylcyclopenta-1,3-dien-1-yl)-1-phenylpentyl]benzene is sourced from PubChem (CID 140630327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).