iodomethylcyclopentane

C6H11I — CID 2762531

IUPACiodomethylcyclopentane
SMILESICC1CCCC1
InChIInChI=1S/C6H11I/c7-5-6-3-1-2-4-6/h6H,1-5H2
InChIKeyDUMSKQUKLVSSII-UHFFFAOYSA-N
MW210.06 g/mol
LogP2.61
Rot. Bonds1

About iodomethylcyclopentane

iodomethylcyclopentane (PubChem CID 2762531) has the molecular formula C6H11I and a molecular weight of 210.06 g/mol. Its IUPAC name is iodomethylcyclopentane.

Molecular Properties

Compound Nameiodomethylcyclopentane
PubChem CID2762531
Molecular FormulaC6H11I
Molecular Weight210.06 g/mol
Exact Mass209.99
IUPAC Nameiodomethylcyclopentane
SMILESICC1CCCC1
InChIInChI=1S/C6H11I/c7-5-6-3-1-2-4-6/h6H,1-5H2
InChIKeyDUMSKQUKLVSSII-UHFFFAOYSA-N
XLogP2.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.06
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of iodomethylcyclopentane?
The IUPAC name of iodomethylcyclopentane (CID 2762531) is iodomethylcyclopentane.
What is the SMILES notation for iodomethylcyclopentane?
The canonical SMILES for iodomethylcyclopentane is ICC1CCCC1.
What is the InChIKey of iodomethylcyclopentane?
The InChIKey is DUMSKQUKLVSSII-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11I/c7-5-6-3-1-2-4-6/h6H,1-5H2.
What are the key properties of iodomethylcyclopentane?
iodomethylcyclopentane has a molecular weight of 210.06 g/mol, XLogP of 2.61, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for iodomethylcyclopentane is sourced from PubChem (CID 2762531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).