N,N'-bis(ethenyl)-2-methylpropanimidamide

C8H14N2 — CID 146604287

IUPACN,N'-bis(ethenyl)-2-methylpropanimidamide
SMILESC=C/N=C(/NC=C)C(C)C
InChIInChI=1S/C8H14N2/c1-5-9-8(7(3)4)10-6-2/h5-7H,1-2H2,3-4H3,(H,9,10)
InChIKeyXCGIXTIHOPIYNZ-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.92
Rot. Bonds3

About N,N'-bis(ethenyl)-2-methylpropanimidamide

N,N'-bis(ethenyl)-2-methylpropanimidamide (PubChem CID 146604287) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is N,N'-bis(ethenyl)-2-methylpropanimidamide.

Molecular Properties

Compound NameN,N'-bis(ethenyl)-2-methylpropanimidamide
PubChem CID146604287
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC NameN,N'-bis(ethenyl)-2-methylpropanimidamide
SMILESC=C/N=C(/NC=C)C(C)C
InChIInChI=1S/C8H14N2/c1-5-9-8(7(3)4)10-6-2/h5-7H,1-2H2,3-4H3,(H,9,10)
InChIKeyXCGIXTIHOPIYNZ-UHFFFAOYSA-N
XLogP1.92
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.92
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'}

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Frequently Asked Questions

What is the IUPAC name of N,N'-bis(ethenyl)-2-methylpropanimidamide?
The IUPAC name of N,N'-bis(ethenyl)-2-methylpropanimidamide (CID 146604287) is N,N'-bis(ethenyl)-2-methylpropanimidamide.
What is the SMILES notation for N,N'-bis(ethenyl)-2-methylpropanimidamide?
The canonical SMILES for N,N'-bis(ethenyl)-2-methylpropanimidamide is C=C/N=C(/NC=C)C(C)C.
What is the InChIKey of N,N'-bis(ethenyl)-2-methylpropanimidamide?
The InChIKey is XCGIXTIHOPIYNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-5-9-8(7(3)4)10-6-2/h5-7H,1-2H2,3-4H3,(H,9,10).
What are the key properties of N,N'-bis(ethenyl)-2-methylpropanimidamide?
N,N'-bis(ethenyl)-2-methylpropanimidamide has a molecular weight of 138.21 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(ethenyl)-2-methylpropanimidamide is sourced from PubChem (CID 146604287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).