N-ethenyl-N',2,2-trimethylpropanimidamide

C8H16N2 — CID 138748651

IUPACN-ethenyl-N',2,2-trimethylpropanimidamide
SMILESC=CN/C(=N\C)C(C)(C)C
InChIInChI=1S/C8H16N2/c1-6-10-7(9-5)8(2,3)4/h6H,1H2,2-5H3,(H,9,10)
InChIKeyNVXDBHPSWQFVLH-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.79
Rot. Bonds1

About N-ethenyl-N',2,2-trimethylpropanimidamide

N-ethenyl-N',2,2-trimethylpropanimidamide (PubChem CID 138748651) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N-ethenyl-N',2,2-trimethylpropanimidamide.

Molecular Properties

Compound NameN-ethenyl-N',2,2-trimethylpropanimidamide
PubChem CID138748651
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN-ethenyl-N',2,2-trimethylpropanimidamide
SMILESC=CN/C(=N\C)C(C)(C)C
InChIInChI=1S/C8H16N2/c1-6-10-7(9-5)8(2,3)4/h6H,1H2,2-5H3,(H,9,10)
InChIKeyNVXDBHPSWQFVLH-UHFFFAOYSA-N
XLogP1.79
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.79
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-ethenyl-N',2,2-trimethylpropanimidamide?
The IUPAC name of N-ethenyl-N',2,2-trimethylpropanimidamide (CID 138748651) is N-ethenyl-N',2,2-trimethylpropanimidamide.
What is the SMILES notation for N-ethenyl-N',2,2-trimethylpropanimidamide?
The canonical SMILES for N-ethenyl-N',2,2-trimethylpropanimidamide is C=CN/C(=N\C)C(C)(C)C.
What is the InChIKey of N-ethenyl-N',2,2-trimethylpropanimidamide?
The InChIKey is NVXDBHPSWQFVLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-6-10-7(9-5)8(2,3)4/h6H,1H2,2-5H3,(H,9,10).
What are the key properties of N-ethenyl-N',2,2-trimethylpropanimidamide?
N-ethenyl-N',2,2-trimethylpropanimidamide has a molecular weight of 140.23 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N',2,2-trimethylpropanimidamide is sourced from PubChem (CID 138748651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).