2-(iodomethoxy)acetamide

C3H6INO2 — CID 142638217

IUPAC2-(iodomethoxy)acetamide
SMILESNC(=O)COCI
InChIInChI=1S/C3H6INO2/c4-2-7-1-3(5)6/h1-2H2,(H2,5,6)
InChIKeyIVLQSHFKKSVRID-UHFFFAOYSA-N
MW214.99 g/mol
LogP-0.12
Rot. Bonds3

About 2-(iodomethoxy)acetamide

2-(iodomethoxy)acetamide (PubChem CID 142638217) has the molecular formula C3H6INO2 and a molecular weight of 214.99 g/mol. Its IUPAC name is 2-(iodomethoxy)acetamide.

Molecular Properties

Compound Name2-(iodomethoxy)acetamide
PubChem CID142638217
Molecular FormulaC3H6INO2
Molecular Weight214.99 g/mol
Exact Mass214.94
IUPAC Name2-(iodomethoxy)acetamide
SMILESNC(=O)COCI
InChIInChI=1S/C3H6INO2/c4-2-7-1-3(5)6/h1-2H2,(H2,5,6)
InChIKeyIVLQSHFKKSVRID-UHFFFAOYSA-N
XLogP-0.12
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.99
LogP ≤ 5-0.12
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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Frequently Asked Questions

What is the IUPAC name of 2-(iodomethoxy)acetamide?
The IUPAC name of 2-(iodomethoxy)acetamide (CID 142638217) is 2-(iodomethoxy)acetamide.
What is the SMILES notation for 2-(iodomethoxy)acetamide?
The canonical SMILES for 2-(iodomethoxy)acetamide is NC(=O)COCI.
What is the InChIKey of 2-(iodomethoxy)acetamide?
The InChIKey is IVLQSHFKKSVRID-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6INO2/c4-2-7-1-3(5)6/h1-2H2,(H2,5,6).
What are the key properties of 2-(iodomethoxy)acetamide?
2-(iodomethoxy)acetamide has a molecular weight of 214.99 g/mol, XLogP of -0.12, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(iodomethoxy)acetamide is sourced from PubChem (CID 142638217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).