2-methyl-2-morpholin-4-ylpropanoyl iodide

C8H14INO2 — CID 155067930

IUPAC2-methyl-2-morpholin-4-ylpropanoyl iodide
SMILESCC(C)(C(=O)I)N1CCOCC1
InChIInChI=1S/C8H14INO2/c1-8(2,7(9)11)10-3-5-12-6-4-10/h3-6H2,1-2H3
InChIKeyCUNFEUCOCMCOSN-UHFFFAOYSA-N
MW283.11 g/mol
LogP1.06
Rot. Bonds2

About 2-methyl-2-morpholin-4-ylpropanoyl iodide

2-methyl-2-morpholin-4-ylpropanoyl iodide (PubChem CID 155067930) has the molecular formula C8H14INO2 and a molecular weight of 283.11 g/mol. Its IUPAC name is 2-methyl-2-morpholin-4-ylpropanoyl iodide.

Molecular Properties

Compound Name2-methyl-2-morpholin-4-ylpropanoyl iodide
PubChem CID155067930
Molecular FormulaC8H14INO2
Molecular Weight283.11 g/mol
Exact Mass283.01
IUPAC Name2-methyl-2-morpholin-4-ylpropanoyl iodide
SMILESCC(C)(C(=O)I)N1CCOCC1
InChIInChI=1S/C8H14INO2/c1-8(2,7(9)11)10-3-5-12-6-4-10/h3-6H2,1-2H3
InChIKeyCUNFEUCOCMCOSN-UHFFFAOYSA-N
XLogP1.06
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.11
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-2-morpholin-4-ylpropanoate
CID 25219445
N,2-dimethyl-2-morpholin-4-ylpropanamide
CID 59526666
N-hydroxy-2-methyl-2-morpholin-4-ylpropanamide
CID 127000284
ethyl 2-methyl-2-morpholin-4-ylpropanoate
CID 13022015
7,7,7-trifluoro-2-methyl-2-morpholin-4-ylheptan-3-one
CID 113326846
2-methyl-2-morpholin-4-ylbutanoic acid
CID 43803225
2-methyl-2-morpholin-4-yl-1-pyrazin-2-ylpropan-1-one
CID 79045873
CID 58998301
CID 58998301
2-morpholin-4-ylpropane-2-thiol
CID 139318537
3-methyl-3-morpholin-4-ylpentanoic acid
CID 64527149
2,5-dimethyl-2-morpholin-4-yloctan-3-one
CID 79045428
N-[(3S,4R)-4-hydroxyoxolan-3-yl]-2-methyl-2-morpholin-4-ylpropanamide
CID 131916649

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-morpholin-4-ylpropanoyl iodide?
The IUPAC name of 2-methyl-2-morpholin-4-ylpropanoyl iodide (CID 155067930) is 2-methyl-2-morpholin-4-ylpropanoyl iodide.
What is the SMILES notation for 2-methyl-2-morpholin-4-ylpropanoyl iodide?
The canonical SMILES for 2-methyl-2-morpholin-4-ylpropanoyl iodide is CC(C)(C(=O)I)N1CCOCC1.
What is the InChIKey of 2-methyl-2-morpholin-4-ylpropanoyl iodide?
The InChIKey is CUNFEUCOCMCOSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14INO2/c1-8(2,7(9)11)10-3-5-12-6-4-10/h3-6H2,1-2H3.
What are the key properties of 2-methyl-2-morpholin-4-ylpropanoyl iodide?
2-methyl-2-morpholin-4-ylpropanoyl iodide has a molecular weight of 283.11 g/mol, XLogP of 1.06, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-morpholin-4-ylpropanoyl iodide is sourced from PubChem (CID 155067930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).