methyl(prop-2-enoxymethyl)azanide

C5H10NO- — CID 160695638

IUPACmethyl(prop-2-enoxymethyl)azanide
SMILESC=CCOC[N-]C
InChIInChI=1S/C5H10NO/c1-3-4-7-5-6-2/h3H,1,4-5H2,2H3/q-1
InChIKeyLNIZCHMRJTZCAF-UHFFFAOYSA-N
MW100.14 g/mol
LogP1.15
Rot. Bonds4

About methyl(prop-2-enoxymethyl)azanide

methyl(prop-2-enoxymethyl)azanide (PubChem CID 160695638) has the molecular formula C5H10NO- and a molecular weight of 100.14 g/mol. Its IUPAC name is methyl(prop-2-enoxymethyl)azanide.

Molecular Properties

Compound Namemethyl(prop-2-enoxymethyl)azanide
PubChem CID160695638
Molecular FormulaC5H10NO-
Molecular Weight100.14 g/mol
Exact Mass100.08
IUPAC Namemethyl(prop-2-enoxymethyl)azanide
SMILESC=CCOC[N-]C
InChIInChI=1S/C5H10NO/c1-3-4-7-5-6-2/h3H,1,4-5H2,2H3/q-1
InChIKeyLNIZCHMRJTZCAF-UHFFFAOYSA-N
XLogP1.15
TPSA23.33 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.14
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methyl(prop-2-enoxymethyl)azanide?
The IUPAC name of methyl(prop-2-enoxymethyl)azanide (CID 160695638) is methyl(prop-2-enoxymethyl)azanide.
What is the SMILES notation for methyl(prop-2-enoxymethyl)azanide?
The canonical SMILES for methyl(prop-2-enoxymethyl)azanide is C=CCOC[N-]C.
What is the InChIKey of methyl(prop-2-enoxymethyl)azanide?
The InChIKey is LNIZCHMRJTZCAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10NO/c1-3-4-7-5-6-2/h3H,1,4-5H2,2H3/q-1.
What are the key properties of methyl(prop-2-enoxymethyl)azanide?
methyl(prop-2-enoxymethyl)azanide has a molecular weight of 100.14 g/mol, XLogP of 1.15, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(prop-2-enoxymethyl)azanide is sourced from PubChem (CID 160695638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).