1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene

C20H24 — CID 143117324

IUPAC1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene
SMILESC=CCC1C(c2ccc(C)cc2)=CCC1C1=CCCC1
InChIInChI=1S/C20H24/c1-3-6-20-18(16-7-4-5-8-16)13-14-19(20)17-11-9-15(2)10-12-17/h3,7,9-12,14,18,20H,1,4-6,8,13H2,2H3
InChIKeyLGXHYOSYYIODJK-UHFFFAOYSA-N
MW264.41 g/mol
LogP5.70
Rot. Bonds4

About 1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene

1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene (PubChem CID 143117324) has the molecular formula C20H24 and a molecular weight of 264.41 g/mol. Its IUPAC name is 1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene.

Molecular Properties

Compound Name1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene
PubChem CID143117324
Molecular FormulaC20H24
Molecular Weight264.41 g/mol
Exact Mass264.19
IUPAC Name1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene
SMILESC=CCC1C(c2ccc(C)cc2)=CCC1C1=CCCC1
InChIInChI=1S/C20H24/c1-3-6-20-18(16-7-4-5-8-16)13-14-19(20)17-11-9-15(2)10-12-17/h3,7,9-12,14,18,20H,1,4-6,8,13H2,2H3
InChIKeyLGXHYOSYYIODJK-UHFFFAOYSA-N
XLogP5.70
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 ≤ 55.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-methyl-4-[6-methyl-5-(2-methyl-3-prop-2-enylcyclopropen-1-yl)cyclohexa-1,5-dien-1-yl]benzene
CID 144661401
2-(4-methylphenyl)bicyclo[3.3.1]non-2-en-9-amine
CID 45098007
17-[(4-methylphenyl)methyl]-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
CID 163249573
3,7-dimethyl-3-(4-methylphenyl)-4-prop-2-enyl-2,4-dihydro-1H-naphthalene
CID 23537876
1-[4-[[4-(but-3-enoxymethyl)cyclohexyl]oxymethyl]cyclohexen-1-yl]-4-methylbenzene
CID 88591312
1-[4-[2-(1-but-3-enoxyethenylperoxy)ethyl]cyclohexen-1-yl]-4-methylbenzene
CID 88591319
3,7-dimethyl-3-(4-methylphenyl)-4-prop-2-enyl-2,4-dihydrothiochromene
CID 20579561
1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene
CID 123748481
1,4-bis[4-(4-prop-2-enylcyclohexyl)cyclohexen-1-yl]benzene
CID 173416619
2-(4-methylphenyl)-1-prop-2-enyl-3,4-dihydro-1H-isoquinoline
CID 134951940
2-methyl-5-[4-(4-methylphenyl)phenyl]bicyclo[4.1.0]hepta-2,4-diene
CID 143326250
2-methyl-5-[4-[4-(4-methylphenyl)phenyl]phenyl]bicyclo[4.1.0]hepta-2,4-diene
CID 164596184

Frequently Asked Questions

What is the IUPAC name of 1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene?
The IUPAC name of 1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene (CID 143117324) is 1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene.
What is the SMILES notation for 1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene?
The canonical SMILES for 1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene is C=CCC1C(c2ccc(C)cc2)=CCC1C1=CCCC1.
What is the InChIKey of 1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene?
The InChIKey is LGXHYOSYYIODJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24/c1-3-6-20-18(16-7-4-5-8-16)13-14-19(20)17-11-9-15(2)10-12-17/h3,7,9-12,14,18,20H,1,4-6,8,13H2,2H3.
What are the key properties of 1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene?
1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene has a molecular weight of 264.41 g/mol, XLogP of 5.70, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(cyclopenten-1-yl)-5-prop-2-enylcyclopenten-1-yl]-4-methylbenzene is sourced from PubChem (CID 143117324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).