N-ethenyl-N-methyl-2-methyliminoethanamine

C6H12N2 — CID 123995998

IUPACN-ethenyl-N-methyl-2-methyliminoethanamine
SMILESC=CN(C)C/C=N/C
InChIInChI=1S/C6H12N2/c1-4-8(3)6-5-7-2/h4-5H,1,6H2,2-3H3/b7-5+
InChIKeyFVOJGHUSNFCITO-FNORWQNLSA-N
MW112.18 g/mol
LogP0.76
Rot. Bonds3

About N-ethenyl-N-methyl-2-methyliminoethanamine

N-ethenyl-N-methyl-2-methyliminoethanamine (PubChem CID 123995998) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is N-ethenyl-N-methyl-2-methyliminoethanamine.

Molecular Properties

Compound NameN-ethenyl-N-methyl-2-methyliminoethanamine
PubChem CID123995998
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC NameN-ethenyl-N-methyl-2-methyliminoethanamine
SMILESC=CN(C)C/C=N/C
InChIInChI=1S/C6H12N2/c1-4-8(3)6-5-7-2/h4-5H,1,6H2,2-3H3/b7-5+
InChIKeyFVOJGHUSNFCITO-FNORWQNLSA-N
XLogP0.76
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 50.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-ethenyl-N-methyl-2-methyliminoethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methanaminium, N-[(2E)-3-(dimethylamino)-2-propenylidene]-N-methyl-
CID 638326
6-Dimethylamino-2,5-diazafulvene
CID 10396839
1-(Prop-1-en-1-yl)-1,2-dihydropyrazine
CID 71361020
(1E)-N-Ethenylethanimine
CID 13099158
Dihydromethylpyrazine
CID 21134130
N-ethylpyrazine
CID 90427580
Methanaminium, N-[3-(dimethylamino)-2-propenylidene]-N-methyl-
CID 3994380
[(Z)-3-(dimethylamino)prop-2-enylidene]-dimethylazanium
CID 96570747
Pyrazinium, 1,4-dimethyl-
CID 17841205
1-propan-2-yl-2H-pyrazine
CID 20641789
1,2-dimethyl-2H-pyrazine
CID 20728182
(E)-N-ethyl-N-methyl-3-methyliminoprop-1-en-1-amine
CID 22084454

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N-methyl-2-methyliminoethanamine?
The IUPAC name of N-ethenyl-N-methyl-2-methyliminoethanamine (CID 123995998) is N-ethenyl-N-methyl-2-methyliminoethanamine.
What is the SMILES notation for N-ethenyl-N-methyl-2-methyliminoethanamine?
The canonical SMILES for N-ethenyl-N-methyl-2-methyliminoethanamine is C=CN(C)C/C=N/C.
What is the InChIKey of N-ethenyl-N-methyl-2-methyliminoethanamine?
The InChIKey is FVOJGHUSNFCITO-FNORWQNLSA-N. The full InChI is InChI=1S/C6H12N2/c1-4-8(3)6-5-7-2/h4-5H,1,6H2,2-3H3/b7-5+.
What are the key properties of N-ethenyl-N-methyl-2-methyliminoethanamine?
N-ethenyl-N-methyl-2-methyliminoethanamine has a molecular weight of 112.18 g/mol, XLogP of 0.76, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N-methyl-2-methyliminoethanamine is sourced from PubChem (CID 123995998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).