2-N-ethenyl-1-N-methylpropane-1,2-diimine

C6H10N2 — CID 88929902

IUPAC2-N-ethenyl-1-N-methylpropane-1,2-diimine
SMILESC=C/N=C(C)/C=N/C
InChIInChI=1S/C6H10N2/c1-4-8-6(2)5-7-3/h4-5H,1H2,2-3H3/b7-5+,8-6+
InChIKeyXGTXIQQSQZJHGB-KQQUZDAGSA-N
MW110.16 g/mol
LogP1.29
Rot. Bonds2

About 2-N-ethenyl-1-N-methylpropane-1,2-diimine

2-N-ethenyl-1-N-methylpropane-1,2-diimine (PubChem CID 88929902) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is 2-N-ethenyl-1-N-methylpropane-1,2-diimine.

Molecular Properties

Compound Name2-N-ethenyl-1-N-methylpropane-1,2-diimine
PubChem CID88929902
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name2-N-ethenyl-1-N-methylpropane-1,2-diimine
SMILESC=C/N=C(C)/C=N/C
InChIInChI=1S/C6H10N2/c1-4-8-6(2)5-7-3/h4-5H,1H2,2-3H3/b7-5+,8-6+
InChIKeyXGTXIQQSQZJHGB-KQQUZDAGSA-N
XLogP1.29
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 51.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-N-ethenyl-1-N-methylpropane-1,2-diimine 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 2-N-ethenyl-1-N-methylpropane-1,2-diimine?
The IUPAC name of 2-N-ethenyl-1-N-methylpropane-1,2-diimine (CID 88929902) is 2-N-ethenyl-1-N-methylpropane-1,2-diimine.
What is the SMILES notation for 2-N-ethenyl-1-N-methylpropane-1,2-diimine?
The canonical SMILES for 2-N-ethenyl-1-N-methylpropane-1,2-diimine is C=C/N=C(C)/C=N/C.
What is the InChIKey of 2-N-ethenyl-1-N-methylpropane-1,2-diimine?
The InChIKey is XGTXIQQSQZJHGB-KQQUZDAGSA-N. The full InChI is InChI=1S/C6H10N2/c1-4-8-6(2)5-7-3/h4-5H,1H2,2-3H3/b7-5+,8-6+.
What are the key properties of 2-N-ethenyl-1-N-methylpropane-1,2-diimine?
2-N-ethenyl-1-N-methylpropane-1,2-diimine has a molecular weight of 110.16 g/mol, XLogP of 1.29, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethenyl-1-N-methylpropane-1,2-diimine is sourced from PubChem (CID 88929902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).