N-methyl-2-methyliminoethanamine

C4H10N2 — CID 54033446

IUPACN-methyl-2-methyliminoethanamine
SMILESC/N=C/CNC
InChIInChI=1S/C4H10N2/c1-5-3-4-6-2/h3,6H,4H2,1-2H3/b5-3+
InChIKeyLHGFJHVJRQXTEU-HWKANZROSA-N
MW86.14 g/mol
LogP-0.09
Rot. Bonds2

About N-methyl-2-methyliminoethanamine

N-methyl-2-methyliminoethanamine (PubChem CID 54033446) has the molecular formula C4H10N2 and a molecular weight of 86.14 g/mol. Its IUPAC name is N-methyl-2-methyliminoethanamine.

Molecular Properties

Compound NameN-methyl-2-methyliminoethanamine
PubChem CID54033446
Molecular FormulaC4H10N2
Molecular Weight86.14 g/mol
Exact Mass86.08
IUPAC NameN-methyl-2-methyliminoethanamine
SMILESC/N=C/CNC
InChIInChI=1S/C4H10N2/c1-5-3-4-6-2/h3,6H,4H2,1-2H3/b5-3+
InChIKeyLHGFJHVJRQXTEU-HWKANZROSA-N
XLogP-0.09
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50086.14
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-methyliminoethanamine?
The IUPAC name of N-methyl-2-methyliminoethanamine (CID 54033446) is N-methyl-2-methyliminoethanamine.
What is the SMILES notation for N-methyl-2-methyliminoethanamine?
The canonical SMILES for N-methyl-2-methyliminoethanamine is C/N=C/CNC.
What is the InChIKey of N-methyl-2-methyliminoethanamine?
The InChIKey is LHGFJHVJRQXTEU-HWKANZROSA-N. The full InChI is InChI=1S/C4H10N2/c1-5-3-4-6-2/h3,6H,4H2,1-2H3/b5-3+.
What are the key properties of N-methyl-2-methyliminoethanamine?
N-methyl-2-methyliminoethanamine has a molecular weight of 86.14 g/mol, XLogP of -0.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-methyliminoethanamine is sourced from PubChem (CID 54033446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).