N'-methyl-N-methylideneethanimidamide

C4H8N2 — CID 18718054

IUPACN'-methyl-N-methylideneethanimidamide
SMILESC=N/C(C)=N/C
InChIInChI=1S/C4H8N2/c1-4(5-2)6-3/h2H2,1,3H3/b6-4+
InChIKeyCLADJUZXKAHRCY-GQCTYLIASA-N
MW84.12 g/mol
LogP0.74
Rot. Bonds

About N'-methyl-N-methylideneethanimidamide

N'-methyl-N-methylideneethanimidamide (PubChem CID 18718054) has the molecular formula C4H8N2 and a molecular weight of 84.12 g/mol. Its IUPAC name is N'-methyl-N-methylideneethanimidamide.

Molecular Properties

Compound NameN'-methyl-N-methylideneethanimidamide
PubChem CID18718054
Molecular FormulaC4H8N2
Molecular Weight84.12 g/mol
Exact Mass84.07
IUPAC NameN'-methyl-N-methylideneethanimidamide
SMILESC=N/C(C)=N/C
InChIInChI=1S/C4H8N2/c1-4(5-2)6-3/h2H2,1,3H3/b6-4+
InChIKeyCLADJUZXKAHRCY-GQCTYLIASA-N
XLogP0.74
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
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'-methyl-N-methylideneethanimidamide?
The IUPAC name of N'-methyl-N-methylideneethanimidamide (CID 18718054) is N'-methyl-N-methylideneethanimidamide.
What is the SMILES notation for N'-methyl-N-methylideneethanimidamide?
The canonical SMILES for N'-methyl-N-methylideneethanimidamide is C=N/C(C)=N/C.
What is the InChIKey of N'-methyl-N-methylideneethanimidamide?
The InChIKey is CLADJUZXKAHRCY-GQCTYLIASA-N. The full InChI is InChI=1S/C4H8N2/c1-4(5-2)6-3/h2H2,1,3H3/b6-4+.
What are the key properties of N'-methyl-N-methylideneethanimidamide?
N'-methyl-N-methylideneethanimidamide has a molecular weight of 84.12 g/mol, XLogP of 0.74, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N-methylideneethanimidamide is sourced from PubChem (CID 18718054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).