2-iodomorpholine;hydroiodide

C4H9I2NO — CID 66958144

IUPAC2-iodomorpholine;hydroiodide
SMILESI.IC1CNCCO1
InChIInChI=1S/C4H8INO.HI/c5-4-3-6-1-2-7-4;/h4,6H,1-3H2;1H
InChIKeyRTOLDKPWVBGWCO-UHFFFAOYSA-N
MW340.93 g/mol
LogP0.99
Rot. Bonds

About 2-iodomorpholine;hydroiodide

2-iodomorpholine;hydroiodide (PubChem CID 66958144) has the molecular formula C4H9I2NO and a molecular weight of 340.93 g/mol. Its IUPAC name is 2-iodomorpholine;hydroiodide.

Molecular Properties

Compound Name2-iodomorpholine;hydroiodide
PubChem CID66958144
Molecular FormulaC4H9I2NO
Molecular Weight340.93 g/mol
Exact Mass340.88
IUPAC Name2-iodomorpholine;hydroiodide
SMILESI.IC1CNCCO1
InChIInChI=1S/C4H8INO.HI/c5-4-3-6-1-2-7-4;/h4,6H,1-3H2;1H
InChIKeyRTOLDKPWVBGWCO-UHFFFAOYSA-N
XLogP0.99
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.93
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 162446410
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CID 67675203
(2S)-morpholine-2-carbonitrile;hydrochloride
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2-[[(2S)-oxiran-2-yl]methyl]morpholine
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CID 97296988

Frequently Asked Questions

What is the IUPAC name of 2-iodomorpholine;hydroiodide?
The IUPAC name of 2-iodomorpholine;hydroiodide (CID 66958144) is 2-iodomorpholine;hydroiodide.
What is the SMILES notation for 2-iodomorpholine;hydroiodide?
The canonical SMILES for 2-iodomorpholine;hydroiodide is I.IC1CNCCO1.
What is the InChIKey of 2-iodomorpholine;hydroiodide?
The InChIKey is RTOLDKPWVBGWCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8INO.HI/c5-4-3-6-1-2-7-4;/h4,6H,1-3H2;1H.
What are the key properties of 2-iodomorpholine;hydroiodide?
2-iodomorpholine;hydroiodide has a molecular weight of 340.93 g/mol, XLogP of 0.99, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-iodomorpholine;hydroiodide is sourced from PubChem (CID 66958144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).