N-(dimethylamino)-N'-ethenylethanimidamide

C6H13N3 — CID 155153167

IUPACN-(dimethylamino)-N'-ethenylethanimidamide
SMILESC=C/N=C(\C)NN(C)C
InChIInChI=1S/C6H13N3/c1-5-7-6(2)8-9(3)4/h5H,1H2,2-4H3,(H,7,8)
InChIKeyBBHZIQMYAOLASZ-UHFFFAOYSA-N
MW127.19 g/mol
LogP0.61
Rot. Bonds2

About N-(dimethylamino)-N'-ethenylethanimidamide

N-(dimethylamino)-N'-ethenylethanimidamide (PubChem CID 155153167) has the molecular formula C6H13N3 and a molecular weight of 127.19 g/mol. Its IUPAC name is N-(dimethylamino)-N'-ethenylethanimidamide.

Molecular Properties

Compound NameN-(dimethylamino)-N'-ethenylethanimidamide
PubChem CID155153167
Molecular FormulaC6H13N3
Molecular Weight127.19 g/mol
Exact Mass127.11
IUPAC NameN-(dimethylamino)-N'-ethenylethanimidamide
SMILESC=C/N=C(\C)NN(C)C
InChIInChI=1S/C6H13N3/c1-5-7-6(2)8-9(3)4/h5H,1H2,2-4H3,(H,7,8)
InChIKeyBBHZIQMYAOLASZ-UHFFFAOYSA-N
XLogP0.61
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(dimethylamino)-N'-ethenylethanimidamide?
The IUPAC name of N-(dimethylamino)-N'-ethenylethanimidamide (CID 155153167) is N-(dimethylamino)-N'-ethenylethanimidamide.
What is the SMILES notation for N-(dimethylamino)-N'-ethenylethanimidamide?
The canonical SMILES for N-(dimethylamino)-N'-ethenylethanimidamide is C=C/N=C(\C)NN(C)C.
What is the InChIKey of N-(dimethylamino)-N'-ethenylethanimidamide?
The InChIKey is BBHZIQMYAOLASZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3/c1-5-7-6(2)8-9(3)4/h5H,1H2,2-4H3,(H,7,8).
What are the key properties of N-(dimethylamino)-N'-ethenylethanimidamide?
N-(dimethylamino)-N'-ethenylethanimidamide has a molecular weight of 127.19 g/mol, XLogP of 0.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dimethylamino)-N'-ethenylethanimidamide is sourced from PubChem (CID 155153167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).