N-methylidenehydroxylamine;molecular iodine

CH3I2NO — CID 91374804

IUPACN-methylidenehydroxylamine;molecular iodine
SMILESC=NO.II
InChIInChI=1S/CH3NO.I2/c1-2-3;1-2/h3H,1H2;
InChIKeySMBMLWITIYLFJR-UHFFFAOYSA-N
MW298.85 g/mol
LogP1.85
Rot. Bonds

About N-methylidenehydroxylamine;molecular iodine

N-methylidenehydroxylamine;molecular iodine (PubChem CID 91374804) has the molecular formula CH3I2NO and a molecular weight of 298.85 g/mol. Its IUPAC name is N-methylidenehydroxylamine;molecular iodine.

Molecular Properties

Compound NameN-methylidenehydroxylamine;molecular iodine
PubChem CID91374804
Molecular FormulaCH3I2NO
Molecular Weight298.85 g/mol
Exact Mass298.83
IUPAC NameN-methylidenehydroxylamine;molecular iodine
SMILESC=NO.II
InChIInChI=1S/CH3NO.I2/c1-2-3;1-2/h3H,1H2;
InChIKeySMBMLWITIYLFJR-UHFFFAOYSA-N
XLogP1.85
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.85
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-methylidenehydroxylamine;molecular iodine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methylidenehydroxylamine;molecular iodine?
The IUPAC name of N-methylidenehydroxylamine;molecular iodine (CID 91374804) is N-methylidenehydroxylamine;molecular iodine.
What is the SMILES notation for N-methylidenehydroxylamine;molecular iodine?
The canonical SMILES for N-methylidenehydroxylamine;molecular iodine is C=NO.II.
What is the InChIKey of N-methylidenehydroxylamine;molecular iodine?
The InChIKey is SMBMLWITIYLFJR-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3NO.I2/c1-2-3;1-2/h3H,1H2;.
What are the key properties of N-methylidenehydroxylamine;molecular iodine?
N-methylidenehydroxylamine;molecular iodine has a molecular weight of 298.85 g/mol, XLogP of 1.85, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylidenehydroxylamine;molecular iodine is sourced from PubChem (CID 91374804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).