methanidyl(prop-2-enoxymethyl)azanium

C5H11NO — CID 160695637

IUPACmethanidyl(prop-2-enoxymethyl)azanium
SMILESC=CCOC[NH2+][CH2-]
InChIInChI=1S/C5H11NO/c1-3-4-7-5-6-2/h3H,1-2,4-6H2
InChIKeyRPYOSYZAMCCGHE-UHFFFAOYSA-N
MW101.15 g/mol
LogP-0.50
Rot. Bonds4

About methanidyl(prop-2-enoxymethyl)azanium

methanidyl(prop-2-enoxymethyl)azanium (PubChem CID 160695637) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is methanidyl(prop-2-enoxymethyl)azanium.

Molecular Properties

Compound Namemethanidyl(prop-2-enoxymethyl)azanium
PubChem CID160695637
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Namemethanidyl(prop-2-enoxymethyl)azanium
SMILESC=CCOC[NH2+][CH2-]
InChIInChI=1S/C5H11NO/c1-3-4-7-5-6-2/h3H,1-2,4-6H2
InChIKeyRPYOSYZAMCCGHE-UHFFFAOYSA-N
XLogP-0.50
TPSA25.84 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 5-0.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Potassium allyloxide
CID 87828396
azane;3-prop-2-enoxyprop-1-ene;hydrochloride
CID 173111955
ethenamine;3-prop-2-enoxyprop-1-ene
CID 174942640
tris(prop-1-ene);3-prop-2-enoxyprop-1-ene
CID 175414947
CID 87625662
CID 87625662
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-prop-2-enoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]prop-1-ene
CID 58112303
prop-2-enoxymethylsilane
CID 123621119
3-(prop-2-enoxymethylsulfanylmethoxy)prop-1-ene
CID 87996510
isocyanic acid;3-prop-2-enoxyprop-1-ene
CID 88728289
3-methanidyloxyprop-1-ene;rutherfordium
CID 162454034
2-prop-2-enoxyethoxysilane
CID 123178671
trimethyl(prop-2-enoxymethyl)silane
CID 175511259

Frequently Asked Questions

What is the IUPAC name of methanidyl(prop-2-enoxymethyl)azanium?
The IUPAC name of methanidyl(prop-2-enoxymethyl)azanium (CID 160695637) is methanidyl(prop-2-enoxymethyl)azanium.
What is the SMILES notation for methanidyl(prop-2-enoxymethyl)azanium?
The canonical SMILES for methanidyl(prop-2-enoxymethyl)azanium is C=CCOC[NH2+][CH2-].
What is the InChIKey of methanidyl(prop-2-enoxymethyl)azanium?
The InChIKey is RPYOSYZAMCCGHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c1-3-4-7-5-6-2/h3H,1-2,4-6H2.
What are the key properties of methanidyl(prop-2-enoxymethyl)azanium?
methanidyl(prop-2-enoxymethyl)azanium has a molecular weight of 101.15 g/mol, XLogP of -0.50, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methanidyl(prop-2-enoxymethyl)azanium is sourced from PubChem (CID 160695637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).