N-ethylidene-N'-methylmethanimidamide

C4H8N2 — CID 18734704

IUPACN-ethylidene-N'-methylmethanimidamide
SMILESC/C=N/C=N/C
InChIInChI=1S/C4H8N2/c1-3-6-4-5-2/h3-4H,1-2H3/b5-4+,6-3+
InChIKeyOFIOCSJUQMXYFC-UTTVJGTNSA-N
MW84.12 g/mol
LogP0.74
Rot. Bonds1

About N-ethylidene-N'-methylmethanimidamide

N-ethylidene-N'-methylmethanimidamide (PubChem CID 18734704) has the molecular formula C4H8N2 and a molecular weight of 84.12 g/mol. Its IUPAC name is N-ethylidene-N'-methylmethanimidamide.

Molecular Properties

Compound NameN-ethylidene-N'-methylmethanimidamide
PubChem CID18734704
Molecular FormulaC4H8N2
Molecular Weight84.12 g/mol
Exact Mass84.07
IUPAC NameN-ethylidene-N'-methylmethanimidamide
SMILESC/C=N/C=N/C
InChIInChI=1S/C4H8N2/c1-3-6-4-5-2/h3-4H,1-2H3/b5-4+,6-3+
InChIKeyOFIOCSJUQMXYFC-UTTVJGTNSA-N
XLogP0.74
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50084.12
LogP ≤ 50.74
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'}

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Frequently Asked Questions

What is the IUPAC name of N-ethylidene-N'-methylmethanimidamide?
The IUPAC name of N-ethylidene-N'-methylmethanimidamide (CID 18734704) is N-ethylidene-N'-methylmethanimidamide.
What is the SMILES notation for N-ethylidene-N'-methylmethanimidamide?
The canonical SMILES for N-ethylidene-N'-methylmethanimidamide is C/C=N/C=N/C.
What is the InChIKey of N-ethylidene-N'-methylmethanimidamide?
The InChIKey is OFIOCSJUQMXYFC-UTTVJGTNSA-N. The full InChI is InChI=1S/C4H8N2/c1-3-6-4-5-2/h3-4H,1-2H3/b5-4+,6-3+.
What are the key properties of N-ethylidene-N'-methylmethanimidamide?
N-ethylidene-N'-methylmethanimidamide has a molecular weight of 84.12 g/mol, XLogP of 0.74, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylidene-N'-methylmethanimidamide is sourced from PubChem (CID 18734704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).