[ethenyl(oxido)amino] methanimidate

C3H5N2O2- — CID 163842739

IUPAC[ethenyl(oxido)amino] methanimidate
SMILES[H]/N=C/ON([O-])C=C
InChIInChI=1S/C3H5N2O2/c1-2-5(6)7-3-4/h2-4H,1H2/q-1/b4-3+
InChIKeyWPNJFTNHZWZVJQ-ONEGZZNKSA-N
MW101.08 g/mol
LogP0.47
Rot. Bonds3

About [ethenyl(oxido)amino] methanimidate

[ethenyl(oxido)amino] methanimidate (PubChem CID 163842739) has the molecular formula C3H5N2O2- and a molecular weight of 101.08 g/mol. Its IUPAC name is [ethenyl(oxido)amino] methanimidate.

Molecular Properties

Compound Name[ethenyl(oxido)amino] methanimidate
PubChem CID163842739
Molecular FormulaC3H5N2O2-
Molecular Weight101.08 g/mol
Exact Mass101.04
IUPAC Name[ethenyl(oxido)amino] methanimidate
SMILES[H]/N=C/ON([O-])C=C
InChIInChI=1S/C3H5N2O2/c1-2-5(6)7-3-4/h2-4H,1H2/q-1/b4-3+
InChIKeyWPNJFTNHZWZVJQ-ONEGZZNKSA-N
XLogP0.47
TPSA59.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.08
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[diazenyl(oxido)amino]oxyiminomethane
CID 163841078
N-[ethenyl(oxido)amino]oxy-N-methylcyclopropanamine
CID 163886195
[(2-dimethanimidoyloxysilyl-1-ethenoxypropan-2-yl)-methanimidoyloxysilyl] methanimidate
CID 123619100
diazene;ruthenium
CID 175399496
N-ethenyl-2-imino-N-methylethanamine
CID 90933998
[[1,1-bis(dimethanimidoyloxysilyl)-4-ethenoxybutyl]-methanimidoyloxysilyl] methanimidate
CID 123715979
tert-butyl methanimidate
CID 54501499
3-methanimidoyloxypropyl formate
CID 177168865
methanimidoyl 2-propan-2-ylbut-3-enoate
CID 163575010
2-methylprop-1-enyl methanimidate
CID 143570958
sulfino methanimidate
CID 174318136
1,1-bis(ethenyl)guanidine
CID 174821814

Frequently Asked Questions

What is the IUPAC name of [ethenyl(oxido)amino] methanimidate?
The IUPAC name of [ethenyl(oxido)amino] methanimidate (CID 163842739) is [ethenyl(oxido)amino] methanimidate.
What is the SMILES notation for [ethenyl(oxido)amino] methanimidate?
The canonical SMILES for [ethenyl(oxido)amino] methanimidate is [H]/N=C/ON([O-])C=C.
What is the InChIKey of [ethenyl(oxido)amino] methanimidate?
The InChIKey is WPNJFTNHZWZVJQ-ONEGZZNKSA-N. The full InChI is InChI=1S/C3H5N2O2/c1-2-5(6)7-3-4/h2-4H,1H2/q-1/b4-3+.
What are the key properties of [ethenyl(oxido)amino] methanimidate?
[ethenyl(oxido)amino] methanimidate has a molecular weight of 101.08 g/mol, XLogP of 0.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [ethenyl(oxido)amino] methanimidate is sourced from PubChem (CID 163842739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).