iodomethylidenecyclopentane

C6H9I — CID 11020076

IUPACiodomethylidenecyclopentane
SMILESIC=C1CCCC1
InChIInChI=1S/C6H9I/c7-5-6-3-1-2-4-6/h5H,1-4H2
InChIKeyALTJMDCMMDVXAJ-UHFFFAOYSA-N
MW208.04 g/mol
LogP2.88
Rot. Bonds

About iodomethylidenecyclopentane

iodomethylidenecyclopentane (PubChem CID 11020076) has the molecular formula C6H9I and a molecular weight of 208.04 g/mol. Its IUPAC name is iodomethylidenecyclopentane.

Molecular Properties

Compound Nameiodomethylidenecyclopentane
PubChem CID11020076
Molecular FormulaC6H9I
Molecular Weight208.04 g/mol
Exact Mass207.97
IUPAC Nameiodomethylidenecyclopentane
SMILESIC=C1CCCC1
InChIInChI=1S/C6H9I/c7-5-6-3-1-2-4-6/h5H,1-4H2
InChIKeyALTJMDCMMDVXAJ-UHFFFAOYSA-N
XLogP2.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.04
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of iodomethylidenecyclopentane?
The IUPAC name of iodomethylidenecyclopentane (CID 11020076) is iodomethylidenecyclopentane.
What is the SMILES notation for iodomethylidenecyclopentane?
The canonical SMILES for iodomethylidenecyclopentane is IC=C1CCCC1.
What is the InChIKey of iodomethylidenecyclopentane?
The InChIKey is ALTJMDCMMDVXAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9I/c7-5-6-3-1-2-4-6/h5H,1-4H2.
What are the key properties of iodomethylidenecyclopentane?
iodomethylidenecyclopentane has a molecular weight of 208.04 g/mol, XLogP of 2.88, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for iodomethylidenecyclopentane is sourced from PubChem (CID 11020076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).