1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene

C10H11I — CID 155001714

IUPAC1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene
SMILESC=CC1=C(/C=C(\C)I)C=CC1
InChIInChI=1S/C10H11I/c1-3-9-5-4-6-10(9)7-8(2)11/h3-4,6-7H,1,5H2,2H3/b8-7+
InChIKeyXOHQTYHTKBRPPM-BQYQJAHWSA-N
MW258.10 g/mol
LogP3.77
Rot. Bonds2

About 1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene

1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene (PubChem CID 155001714) has the molecular formula C10H11I and a molecular weight of 258.10 g/mol. Its IUPAC name is 1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene.

Molecular Properties

Compound Name1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene
PubChem CID155001714
Molecular FormulaC10H11I
Molecular Weight258.10 g/mol
Exact Mass257.99
IUPAC Name1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene
SMILESC=CC1=C(/C=C(\C)I)C=CC1
InChIInChI=1S/C10H11I/c1-3-9-5-4-6-10(9)7-8(2)11/h3-4,6-7H,1,5H2,2H3/b8-7+
InChIKeyXOHQTYHTKBRPPM-BQYQJAHWSA-N
XLogP3.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.10
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethane;1-ethenyl-2-[(Z)-prop-1-enyl]cyclopenta-1,3-diene;2-ethylcyclopentan-1-ol
CID 144517174
1,2-bis(ethenyl)-3-methylidenecyclohexa-1,4-diene
CID 145268237
2-ethenyl-N,N,6-trimethylcyclohepta-1,4,6-trien-1-amine
CID 143195302
8-ethenyl-N-methyl-7H-naphthalen-1-imine
CID 146638891
3-[(2-ethenylcyclopenta-1,4-dien-1-yl)methoxy]propan-1-ol
CID 118013151
1-(3-methylidenecyclohexa-1,5-dien-1-yl)ethanone
CID 91334375
1,2-bis(ethenyl)-5-methylcyclohexa-1,3-diene
CID 145377797
1-ethenyl-2-[(Z)-2-methylbut-1-enyl]cyclohexene
CID 142010020
2-trimethylsilylcyclopenta-1,3-diene-1-carbaldehyde
CID 15205236
1-bromo-2-ethenylcyclohexa-1,3-diene
CID 142476555
ethane;2-ethenyl-1-[(Z)-prop-1-enyl]cyclopenta-1,3-diene;methyl 4-(2,3-dihydro-1H-inden-2-ylmethyl)benzoate
CID 144517118
2-ethenyl-4-methyl-1-(2-methylprop-1-enyl)cyclohexene
CID 143209894

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene?
The IUPAC name of 1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene (CID 155001714) is 1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene.
What is the SMILES notation for 1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene?
The canonical SMILES for 1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene is C=CC1=C(/C=C(\C)I)C=CC1.
What is the InChIKey of 1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene?
The InChIKey is XOHQTYHTKBRPPM-BQYQJAHWSA-N. The full InChI is InChI=1S/C10H11I/c1-3-9-5-4-6-10(9)7-8(2)11/h3-4,6-7H,1,5H2,2H3/b8-7+.
What are the key properties of 1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene?
1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene has a molecular weight of 258.10 g/mol, XLogP of 3.77, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-2-[(E)-2-iodoprop-1-enyl]cyclopenta-1,3-diene is sourced from PubChem (CID 155001714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).