1,2-dimethanidylcyclopropane

C5H8-2 — CID 58892113

IUPAC1,2-dimethanidylcyclopropane
SMILES[CH2-]C1CC1[CH2-]
InChIInChI=1S/C5H8/c1-4-3-5(4)2/h4-5H,1-3H2/q-2
InChIKeyVIUZUVBNZNQZPH-UHFFFAOYSA-N
MW68.12 g/mol
LogP1.29
Rot. Bonds

About 1,2-dimethanidylcyclopropane

1,2-dimethanidylcyclopropane (PubChem CID 58892113) has the molecular formula C5H8-2 and a molecular weight of 68.12 g/mol. Its IUPAC name is 1,2-dimethanidylcyclopropane.

Molecular Properties

Compound Name1,2-dimethanidylcyclopropane
PubChem CID58892113
Molecular FormulaC5H8-2
Molecular Weight68.12 g/mol
Exact Mass68.06
IUPAC Name1,2-dimethanidylcyclopropane
SMILES[CH2-]C1CC1[CH2-]
InChIInChI=1S/C5H8/c1-4-3-5(4)2/h4-5H,1-3H2/q-2
InChIKeyVIUZUVBNZNQZPH-UHFFFAOYSA-N
XLogP1.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50068.12
LogP ≤ 51.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

zinc methanidylcyclopropane
CID 142531158
3,4-dimethanidyl-1-methylpyrrolidine;vanadium(2+)
CID 174116308
zinc bis(2-methanidyl-6,6-dimethylbicyclo[3.1.1]heptane)
CID 19695024
zinc bis((1S,5S)-2-methanidyl-6,6-dimethylbicyclo[3.1.1]heptane)
CID 24943249
1-ethyl-3-methanidylcyclobutane
CID 90731604
1,4-dimethanidylcyclohexane;tungsten;vanadium
CID 172528900
2-methanidyloxirane;titanium
CID 154149762
methanidylcyclopentane
CID 91330716
pentacyclo[9.5.1.13,9.15,15.17,13]icosane
CID 86001136
magnesium;1-methanidyl-2-methylcyclohexane;chloride
CID 78064441
methanidylcyclopentane;vanadium
CID 150751230
bis(1,1-dimethanidylphospholan-1-ium);bis(gold(1+))
CID 135083055

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethanidylcyclopropane?
The IUPAC name of 1,2-dimethanidylcyclopropane (CID 58892113) is 1,2-dimethanidylcyclopropane.
What is the SMILES notation for 1,2-dimethanidylcyclopropane?
The canonical SMILES for 1,2-dimethanidylcyclopropane is [CH2-]C1CC1[CH2-].
What is the InChIKey of 1,2-dimethanidylcyclopropane?
The InChIKey is VIUZUVBNZNQZPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8/c1-4-3-5(4)2/h4-5H,1-3H2/q-2.
What are the key properties of 1,2-dimethanidylcyclopropane?
1,2-dimethanidylcyclopropane has a molecular weight of 68.12 g/mol, XLogP of 1.29, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethanidylcyclopropane is sourced from PubChem (CID 58892113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).