N'-ethyl-N-methylmethanediimine;hydrochloride

C4H9ClN2 — CID 174911040

IUPACN'-ethyl-N-methylmethanediimine;hydrochloride
SMILESCCN=C=NC.Cl
InChIInChI=1S/C4H8N2.ClH/c1-3-6-4-5-2;/h3H2,1-2H3;1H
InChIKeyHSOCJLIEUFQCSU-UHFFFAOYSA-N
MW120.58 g/mol
LogP1.23
Rot. Bonds1

About N'-ethyl-N-methylmethanediimine;hydrochloride

N'-ethyl-N-methylmethanediimine;hydrochloride (PubChem CID 174911040) has the molecular formula C4H9ClN2 and a molecular weight of 120.58 g/mol. Its IUPAC name is N'-ethyl-N-methylmethanediimine;hydrochloride.

Molecular Properties

Compound NameN'-ethyl-N-methylmethanediimine;hydrochloride
PubChem CID174911040
Molecular FormulaC4H9ClN2
Molecular Weight120.58 g/mol
Exact Mass120.05
IUPAC NameN'-ethyl-N-methylmethanediimine;hydrochloride
SMILESCCN=C=NC.Cl
InChIInChI=1S/C4H8N2.ClH/c1-3-6-4-5-2;/h3H2,1-2H3;1H
InChIKeyHSOCJLIEUFQCSU-UHFFFAOYSA-N
XLogP1.23
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.58
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

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3-methyl-1-(methyliminomethylideneamino)pentan-3-amine
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Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N-methylmethanediimine;hydrochloride?
The IUPAC name of N'-ethyl-N-methylmethanediimine;hydrochloride (CID 174911040) is N'-ethyl-N-methylmethanediimine;hydrochloride.
What is the SMILES notation for N'-ethyl-N-methylmethanediimine;hydrochloride?
The canonical SMILES for N'-ethyl-N-methylmethanediimine;hydrochloride is CCN=C=NC.Cl.
What is the InChIKey of N'-ethyl-N-methylmethanediimine;hydrochloride?
The InChIKey is HSOCJLIEUFQCSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2.ClH/c1-3-6-4-5-2;/h3H2,1-2H3;1H.
What are the key properties of N'-ethyl-N-methylmethanediimine;hydrochloride?
N'-ethyl-N-methylmethanediimine;hydrochloride has a molecular weight of 120.58 g/mol, XLogP of 1.23, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N-methylmethanediimine;hydrochloride is sourced from PubChem (CID 174911040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).