methyl-oxido-oxidophosphanylideneazanium

CH3NO2P- — CID 174536887

IUPACmethyl-oxido-oxidophosphanylideneazanium
SMILESC/[N+]([O-])=P\[O-]
InChIInChI=1S/CH3NO2P/c1-2(3)5-4/h1H3/q-1
InChIKeyAXZBQXDNNZGYDN-UHFFFAOYSA-N
MW92.01 g/mol
LogP-0.47
Rot. Bonds

About methyl-oxido-oxidophosphanylideneazanium

methyl-oxido-oxidophosphanylideneazanium (PubChem CID 174536887) has the molecular formula CH3NO2P- and a molecular weight of 92.01 g/mol. Its IUPAC name is methyl-oxido-oxidophosphanylideneazanium.

Molecular Properties

Compound Namemethyl-oxido-oxidophosphanylideneazanium
PubChem CID174536887
Molecular FormulaCH3NO2P-
Molecular Weight92.01 g/mol
Exact Mass91.99
IUPAC Namemethyl-oxido-oxidophosphanylideneazanium
SMILESC/[N+]([O-])=P\[O-]
InChIInChI=1S/CH3NO2P/c1-2(3)5-4/h1H3/q-1
InChIKeyAXZBQXDNNZGYDN-UHFFFAOYSA-N
XLogP-0.47
TPSA49.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50092.01
LogP ≤ 5-0.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

nitromethane;hydroiodide
CID 159753263
ethene;nitromethane
CID 161480182
molecular nitrogen;nitromethane
CID 141240049
methyl nitrate
CID 11724
sodium (Z)-methyl-oxido-oxidoiminoazanium
CID 172966410
calcium methyl nitrate
CID 87508998
erbium(3+);trinitrate;tetrahydrate
CID 172858515
2-methyl-3-nitrobutane
CID 13185641
(Z)-2-iodoethoxyimino-methyl-oxidoazanium
CID 28693830
(1-amino-2-methyl-1-oxopropan-2-yl) nitrate
CID 89262322
benzene;nitromethane;propane
CID 90897925
CID 174714129
CID 174714129

Frequently Asked Questions

What is the IUPAC name of methyl-oxido-oxidophosphanylideneazanium?
The IUPAC name of methyl-oxido-oxidophosphanylideneazanium (CID 174536887) is methyl-oxido-oxidophosphanylideneazanium.
What is the SMILES notation for methyl-oxido-oxidophosphanylideneazanium?
The canonical SMILES for methyl-oxido-oxidophosphanylideneazanium is C/[N+]([O-])=P\[O-].
What is the InChIKey of methyl-oxido-oxidophosphanylideneazanium?
The InChIKey is AXZBQXDNNZGYDN-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3NO2P/c1-2(3)5-4/h1H3/q-1.
What are the key properties of methyl-oxido-oxidophosphanylideneazanium?
methyl-oxido-oxidophosphanylideneazanium has a molecular weight of 92.01 g/mol, XLogP of -0.47, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-oxido-oxidophosphanylideneazanium is sourced from PubChem (CID 174536887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).