N'-ethenyl-N-propylidenemethanimidamide

C6H10N2 — CID 129142748

IUPACN'-ethenyl-N-propylidenemethanimidamide
SMILESC=C/N=C/N=C/CC
InChIInChI=1S/C6H10N2/c1-3-5-8-6-7-4-2/h4-6H,2-3H2,1H3/b7-6+,8-5+
InChIKeyIDAUPKWYSMDQDW-ZCOYIIAOSA-N
MW110.16 g/mol
LogP1.64
Rot. Bonds3

About N'-ethenyl-N-propylidenemethanimidamide

N'-ethenyl-N-propylidenemethanimidamide (PubChem CID 129142748) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is N'-ethenyl-N-propylidenemethanimidamide.

Molecular Properties

Compound NameN'-ethenyl-N-propylidenemethanimidamide
PubChem CID129142748
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC NameN'-ethenyl-N-propylidenemethanimidamide
SMILESC=C/N=C/N=C/CC
InChIInChI=1S/C6H10N2/c1-3-5-8-6-7-4-2/h4-6H,2-3H2,1H3/b7-6+,8-5+
InChIKeyIDAUPKWYSMDQDW-ZCOYIIAOSA-N
XLogP1.64
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 51.64
H-Bond Donors ≤ 50
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'-ethenyl-N-propylidenemethanimidamide 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'-ethenyl-N-propylidenemethanimidamide?
The IUPAC name of N'-ethenyl-N-propylidenemethanimidamide (CID 129142748) is N'-ethenyl-N-propylidenemethanimidamide.
What is the SMILES notation for N'-ethenyl-N-propylidenemethanimidamide?
The canonical SMILES for N'-ethenyl-N-propylidenemethanimidamide is C=C/N=C/N=C/CC.
What is the InChIKey of N'-ethenyl-N-propylidenemethanimidamide?
The InChIKey is IDAUPKWYSMDQDW-ZCOYIIAOSA-N. The full InChI is InChI=1S/C6H10N2/c1-3-5-8-6-7-4-2/h4-6H,2-3H2,1H3/b7-6+,8-5+.
What are the key properties of N'-ethenyl-N-propylidenemethanimidamide?
N'-ethenyl-N-propylidenemethanimidamide has a molecular weight of 110.16 g/mol, XLogP of 1.64, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethenyl-N-propylidenemethanimidamide is sourced from PubChem (CID 129142748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).