[2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide

C5H10N2O2 — CID 163873619

IUPAC[2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide
SMILESC=C(CO[N+](=C)[NH-])OC
InChIInChI=1S/C5H10N2O2/c1-5(8-3)4-9-7(2)6/h6H,1-2,4H2,3H3
InChIKeyPMZMMNWHFOSCGC-UHFFFAOYSA-N
MW130.15 g/mol
LogP0.76
Rot. Bonds4

About [2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide

[2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide (PubChem CID 163873619) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is [2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide.

Molecular Properties

Compound Name[2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide
PubChem CID163873619
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name[2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide
SMILESC=C(CO[N+](=C)[NH-])OC
InChIInChI=1S/C5H10N2O2/c1-5(8-3)4-9-7(2)6/h6H,1-2,4H2,3H3
InChIKeyPMZMMNWHFOSCGC-UHFFFAOYSA-N
XLogP0.76
TPSA45.27 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 50.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Related Compounds

2-methoxypenta-1,4-diene
CID 12625760
2-ethoxybut-1-ene;2-methoxybut-1-ene
CID 139345076
2-methoxyprop-2-ene-1-sulfonic acid
CID 175208097
dimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane
CID 123453217
2-methoxyicos-1-ene
CID 175283491
(2R)-4-methoxy-2-methylpent-4-en-1-amine
CID 163577748
sodium 2-methoxyprop-2-enyl-oxido-oxophosphanium
CID 86738483
N-ethyl-4-methoxypent-4-en-1-amine
CID 142218478
2-methoxyocta-1,7-diene
CID 16726270
12-methoxy-N-methyltridec-12-en-1-amine
CID 145295234
1-fluoro-N-(methoxymethyl)ethenamine
CID 130438085
3-ethyl-2-methoxypent-1-en-3-ol
CID 89149604

Frequently Asked Questions

What is the IUPAC name of [2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide?
The IUPAC name of [2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide (CID 163873619) is [2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide.
What is the SMILES notation for [2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide?
The canonical SMILES for [2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide is C=C(CO[N+](=C)[NH-])OC.
What is the InChIKey of [2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide?
The InChIKey is PMZMMNWHFOSCGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2/c1-5(8-3)4-9-7(2)6/h6H,1-2,4H2,3H3.
What are the key properties of [2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide?
[2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide has a molecular weight of 130.15 g/mol, XLogP of 0.76, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxyprop-2-enoxy(methylidene)azaniumyl]azanide is sourced from PubChem (CID 163873619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).