1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane

C14H24 — CID 123506787

IUPAC1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane
SMILESC=CC1CC(C)CC1C=CC(C)(C)C
InChIInChI=1S/C14H24/c1-6-12-9-11(2)10-13(12)7-8-14(3,4)5/h6-8,11-13H,1,9-10H2,2-5H3
InChIKeyJLWWWBKIZUEKJH-UHFFFAOYSA-N
MW192.35 g/mol
LogP4.44
Rot. Bonds2

About 1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane

1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane (PubChem CID 123506787) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane.

Molecular Properties

Compound Name1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane
PubChem CID123506787
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane
SMILESC=CC1CC(C)CC1C=CC(C)(C)C
InChIInChI=1S/C14H24/c1-6-12-9-11(2)10-13(12)7-8-14(3,4)5/h6-8,11-13H,1,9-10H2,2-5H3
InChIKeyJLWWWBKIZUEKJH-UHFFFAOYSA-N
XLogP4.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.44
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

2-ethenyl-4-methylcyclopentan-1-ol
CID 142139319
1,3-bis(ethenyl)-5-methyl-1,2,3,3a,4,5,6,6a-octahydropentalene
CID 162270602
1,2,4-tris(ethenyl)-5-methylcyclohexane
CID 91133944
1-[(E)-3,3-dimethylbut-1-enyl]-4-methylcyclohexane
CID 158566713
2-[(E)-3,3-dimethylbut-1-enyl]-4-methylpyrrolidine
CID 146324331
1-ethenyl-2-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-henicosafluorodecyl)-4-methylcyclopentane
CID 130218430
1-ethenyl-2-pent-1-enylcyclopropane
CID 123214282
1-ethenyl-2-hexa-1,3-dienylcyclopropane
CID 556411
1-ethenyl-2-[(Z)-hex-1-enyl]cyclopropane
CID 5367331
2-ethenyl-5-methylcyclohexan-1-ol
CID 58534305
1-tert-butyl-2,4-bis(ethenyl)cyclopentane
CID 58961448
ethene;bis(2,2,5,5-tetramethylhex-3-ene)
CID 162279391

Frequently Asked Questions

What is the IUPAC name of 1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane?
The IUPAC name of 1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane (CID 123506787) is 1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane.
What is the SMILES notation for 1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane?
The canonical SMILES for 1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane is C=CC1CC(C)CC1C=CC(C)(C)C.
What is the InChIKey of 1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane?
The InChIKey is JLWWWBKIZUEKJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-6-12-9-11(2)10-13(12)7-8-14(3,4)5/h6-8,11-13H,1,9-10H2,2-5H3.
What are the key properties of 1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane?
1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane has a molecular weight of 192.35 g/mol, XLogP of 4.44, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,3-dimethylbut-1-enyl)-2-ethenyl-4-methylcyclopentane is sourced from PubChem (CID 123506787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).