N'-methylprop-2-enimidamide

C4H8N2 — CID 58774648

IUPACN'-methylprop-2-enimidamide
SMILESC=C/C(N)=N\C
InChIInChI=1S/C4H8N2/c1-3-4(5)6-2/h3H,1H2,2H3,(H2,5,6)
InChIKeyHEZFNHCADLDVKN-UHFFFAOYSA-N
MW84.12 g/mol
LogP0.16
Rot. Bonds1

About N'-methylprop-2-enimidamide

N'-methylprop-2-enimidamide (PubChem CID 58774648) has the molecular formula C4H8N2 and a molecular weight of 84.12 g/mol. Its IUPAC name is N'-methylprop-2-enimidamide.

Molecular Properties

Compound NameN'-methylprop-2-enimidamide
PubChem CID58774648
Molecular FormulaC4H8N2
Molecular Weight84.12 g/mol
Exact Mass84.07
IUPAC NameN'-methylprop-2-enimidamide
SMILESC=C/C(N)=N\C
InChIInChI=1S/C4H8N2/c1-3-4(5)6-2/h3H,1H2,2H3,(H2,5,6)
InChIKeyHEZFNHCADLDVKN-UHFFFAOYSA-N
XLogP0.16
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50084.12
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze N'-methylprop-2-enimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-methylprop-2-enimidamide?
The IUPAC name of N'-methylprop-2-enimidamide (CID 58774648) is N'-methylprop-2-enimidamide.
What is the SMILES notation for N'-methylprop-2-enimidamide?
The canonical SMILES for N'-methylprop-2-enimidamide is C=C/C(N)=N\C.
What is the InChIKey of N'-methylprop-2-enimidamide?
The InChIKey is HEZFNHCADLDVKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2/c1-3-4(5)6-2/h3H,1H2,2H3,(H2,5,6).
What are the key properties of N'-methylprop-2-enimidamide?
N'-methylprop-2-enimidamide has a molecular weight of 84.12 g/mol, XLogP of 0.16, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methylprop-2-enimidamide is sourced from PubChem (CID 58774648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).