prop-2-enylazanium

C3H8N+ — CID 5153084

IUPACprop-2-enylazanium
SMILESC=CC[NH3+]
InChIInChI=1S/C3H7N/c1-2-3-4/h2H,1,3-4H2/p+1
InChIKeyVVJKKWFAADXIJK-UHFFFAOYSA-O
MW58.10 g/mol
LogP-0.59
Rot. Bonds1

About prop-2-enylazanium

prop-2-enylazanium (PubChem CID 5153084) has the molecular formula C3H8N+ and a molecular weight of 58.10 g/mol. Its IUPAC name is prop-2-enylazanium.

Molecular Properties

Compound Nameprop-2-enylazanium
PubChem CID5153084
Molecular FormulaC3H8N+
Molecular Weight58.10 g/mol
Exact Mass58.07
IUPAC Nameprop-2-enylazanium
SMILESC=CC[NH3+]
InChIInChI=1S/C3H7N/c1-2-3-4/h2H,1,3-4H2/p+1
InChIKeyVVJKKWFAADXIJK-UHFFFAOYSA-O
XLogP-0.59
TPSA27.64 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50058.10
LogP ≤ 5-0.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of prop-2-enylazanium?
The IUPAC name of prop-2-enylazanium (CID 5153084) is prop-2-enylazanium.
What is the SMILES notation for prop-2-enylazanium?
The canonical SMILES for prop-2-enylazanium is C=CC[NH3+].
What is the InChIKey of prop-2-enylazanium?
The InChIKey is VVJKKWFAADXIJK-UHFFFAOYSA-O. The full InChI is InChI=1S/C3H7N/c1-2-3-4/h2H,1,3-4H2/p+1.
What are the key properties of prop-2-enylazanium?
prop-2-enylazanium has a molecular weight of 58.10 g/mol, XLogP of -0.59, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for prop-2-enylazanium is sourced from PubChem (CID 5153084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).