8-iodoindolizine

C8H6IN — CID 134691902

IUPAC8-iodoindolizine
SMILESIc1cccn2cccc12
InChIInChI=1S/C8H6IN/c9-7-3-1-5-10-6-2-4-8(7)10/h1-6H
InChIKeyUPHPLDITAWMUDQ-UHFFFAOYSA-N
MW243.05 g/mol
LogP2.54
Rot. Bonds

About 8-iodoindolizine

8-iodoindolizine (PubChem CID 134691902) has the molecular formula C8H6IN and a molecular weight of 243.05 g/mol. Its IUPAC name is 8-iodoindolizine.

Molecular Properties

Compound Name8-iodoindolizine
PubChem CID134691902
Molecular FormulaC8H6IN
Molecular Weight243.05 g/mol
Exact Mass242.95
IUPAC Name8-iodoindolizine
SMILESIc1cccn2cccc12
InChIInChI=1S/C8H6IN/c9-7-3-1-5-10-6-2-4-8(7)10/h1-6H
InChIKeyUPHPLDITAWMUDQ-UHFFFAOYSA-N
XLogP2.54
TPSA4.41 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.05
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

indolizin-8-ylmethanol
CID 134862456
CID 136846530
CID 136846530
3,4,6,9-tetrazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,7,10-pentaene
CID 58518078
N-indolizin-8-ylbenzamide
CID 159451185
1,2-diiodobenzene;tetrahydrofluoride
CID 174612997
ethane;indolizine;indolizine-1-carbaldehyde
CID 158153526
indolizine
CID 9230
1,2,3-triiodobenzene
CID 139071365
2-(2,6-diiodophenyl)-1,3-diiodobenzene
CID 91384938
1-ethyl-2-methylpyrrolo[1,2-a]pyrazin-2-ium
CID 778608
[1,2]oxazolo[4,3-g]indolizine
CID 45099171
2-methyl-1-phenylpyrrolo[1,2-a]pyrazin-2-ium iodide
CID 2826919

Frequently Asked Questions

What is the IUPAC name of 8-iodoindolizine?
The IUPAC name of 8-iodoindolizine (CID 134691902) is 8-iodoindolizine.
What is the SMILES notation for 8-iodoindolizine?
The canonical SMILES for 8-iodoindolizine is Ic1cccn2cccc12.
What is the InChIKey of 8-iodoindolizine?
The InChIKey is UPHPLDITAWMUDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6IN/c9-7-3-1-5-10-6-2-4-8(7)10/h1-6H.
What are the key properties of 8-iodoindolizine?
8-iodoindolizine has a molecular weight of 243.05 g/mol, XLogP of 2.54, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-iodoindolizine is sourced from PubChem (CID 134691902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).