dimethyl(methylidene)azanium;hydroiodide

C3H9IN+ — CID 45051693

IUPACdimethyl(methylidene)azanium;hydroiodide
SMILESC=[N+](C)C.I
InChIInChI=1S/C3H8N.HI/c1-4(2)3;/h1H2,2-3H3;1H/q+1;
InChIKeyVVDUZZGYBOWDSQ-UHFFFAOYSA-N
MW186.02 g/mol
LogP0.58
Rot. Bonds

About dimethyl(methylidene)azanium;hydroiodide

dimethyl(methylidene)azanium;hydroiodide (PubChem CID 45051693) has the molecular formula C3H9IN+ and a molecular weight of 186.02 g/mol. Its IUPAC name is dimethyl(methylidene)azanium;hydroiodide.

Molecular Properties

Compound Namedimethyl(methylidene)azanium;hydroiodide
PubChem CID45051693
Molecular FormulaC3H9IN+
Molecular Weight186.02 g/mol
Exact Mass185.98
IUPAC Namedimethyl(methylidene)azanium;hydroiodide
SMILESC=[N+](C)C.I
InChIInChI=1S/C3H8N.HI/c1-4(2)3;/h1H2,2-3H3;1H/q+1;
InChIKeyVVDUZZGYBOWDSQ-UHFFFAOYSA-N
XLogP0.58
TPSA3.01 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.02
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Related Compounds

dimethyl(methylidene)azanium;methyl(methylidyne)azanium;tetramethylazanium
CID 158011582
methyl-methylidene-prop-1-en-2-ylazanium
CID 123573311
ethane;methoxy-methyl-methylideneazanium
CID 158329110
dimethyl(methylidene)azanium;2,2,2-trifluoroacetate
CID 11298207
CID 165030833
CID 165030833
ethane;hydroxy-methyl-methylideneazanium;hydroxy(trimethyl)azanium
CID 159411313
nitromethane;hydroiodide
CID 159753263
[(2R)-butan-2-yl]-methyl-methylideneazanium
CID 148928636
ethene;nitromethane
CID 161480182
bis(ethenylidene(dimethyl)azanium) dichloride
CID 173014859
dimethyl-[[[methyl(methylidene)azaniumyl]methylideneamino]methylidene]azanium
CID 153430260
methyl-methylidene-(methyliminomethylsulfanyl)azanium
CID 88935181

Frequently Asked Questions

What is the IUPAC name of dimethyl(methylidene)azanium;hydroiodide?
The IUPAC name of dimethyl(methylidene)azanium;hydroiodide (CID 45051693) is dimethyl(methylidene)azanium;hydroiodide.
What is the SMILES notation for dimethyl(methylidene)azanium;hydroiodide?
The canonical SMILES for dimethyl(methylidene)azanium;hydroiodide is C=[N+](C)C.I.
What is the InChIKey of dimethyl(methylidene)azanium;hydroiodide?
The InChIKey is VVDUZZGYBOWDSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N.HI/c1-4(2)3;/h1H2,2-3H3;1H/q+1;.
What are the key properties of dimethyl(methylidene)azanium;hydroiodide?
dimethyl(methylidene)azanium;hydroiodide has a molecular weight of 186.02 g/mol, XLogP of 0.58, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl(methylidene)azanium;hydroiodide is sourced from PubChem (CID 45051693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).