N-ethenyl-N-methylethanamine

C5H11N — CID 12556475

IUPACN-ethenyl-N-methylethanamine
SMILESC=CN(C)CC
InChIInChI=1S/C5H11N/c1-4-6(3)5-2/h4H,1,5H2,2-3H3
InChIKeyOARGTCOLYMEKPB-UHFFFAOYSA-N
MW85.15 g/mol
LogP1.08
Rot. Bonds2

About N-ethenyl-N-methylethanamine

N-ethenyl-N-methylethanamine (PubChem CID 12556475) has the molecular formula C5H11N and a molecular weight of 85.15 g/mol. Its IUPAC name is N-ethenyl-N-methylethanamine.

Molecular Properties

Compound NameN-ethenyl-N-methylethanamine
PubChem CID12556475
Molecular FormulaC5H11N
Molecular Weight85.15 g/mol
Exact Mass85.09
IUPAC NameN-ethenyl-N-methylethanamine
SMILESC=CN(C)CC
InChIInChI=1S/C5H11N/c1-4-6(3)5-2/h4H,1,5H2,2-3H3
InChIKeyOARGTCOLYMEKPB-UHFFFAOYSA-N
XLogP1.08
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50085.15
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-ethenyl-N-methylethanamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N-methylethanamine?
The IUPAC name of N-ethenyl-N-methylethanamine (CID 12556475) is N-ethenyl-N-methylethanamine.
What is the SMILES notation for N-ethenyl-N-methylethanamine?
The canonical SMILES for N-ethenyl-N-methylethanamine is C=CN(C)CC.
What is the InChIKey of N-ethenyl-N-methylethanamine?
The InChIKey is OARGTCOLYMEKPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N/c1-4-6(3)5-2/h4H,1,5H2,2-3H3.
What are the key properties of N-ethenyl-N-methylethanamine?
N-ethenyl-N-methylethanamine has a molecular weight of 85.15 g/mol, XLogP of 1.08, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N-methylethanamine is sourced from PubChem (CID 12556475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).