N-iodo-N-methylhydroxylamine

CH4INO — CID 59260427

IUPACN-iodo-N-methylhydroxylamine
SMILESCN(O)I
InChIInChI=1S/CH4INO/c1-3(2)4/h4H,1H3
InChIKeyASKUJAAUIYYSNY-UHFFFAOYSA-N
MW172.95 g/mol
LogP0.66
Rot. Bonds

About N-iodo-N-methylhydroxylamine

N-iodo-N-methylhydroxylamine (PubChem CID 59260427) has the molecular formula CH4INO and a molecular weight of 172.95 g/mol. Its IUPAC name is N-iodo-N-methylhydroxylamine.

Molecular Properties

Compound NameN-iodo-N-methylhydroxylamine
PubChem CID59260427
Molecular FormulaCH4INO
Molecular Weight172.95 g/mol
Exact Mass172.93
IUPAC NameN-iodo-N-methylhydroxylamine
SMILESCN(O)I
InChIInChI=1S/CH4INO/c1-3(2)4/h4H,1H3
InChIKeyASKUJAAUIYYSNY-UHFFFAOYSA-N
XLogP0.66
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.95
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-iodo-N-methylhydroxylamine?
The IUPAC name of N-iodo-N-methylhydroxylamine (CID 59260427) is N-iodo-N-methylhydroxylamine.
What is the SMILES notation for N-iodo-N-methylhydroxylamine?
The canonical SMILES for N-iodo-N-methylhydroxylamine is CN(O)I.
What is the InChIKey of N-iodo-N-methylhydroxylamine?
The InChIKey is ASKUJAAUIYYSNY-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4INO/c1-3(2)4/h4H,1H3.
What are the key properties of N-iodo-N-methylhydroxylamine?
N-iodo-N-methylhydroxylamine has a molecular weight of 172.95 g/mol, XLogP of 0.66, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-iodo-N-methylhydroxylamine is sourced from PubChem (CID 59260427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).