N-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine

C9H14N2 — CID 123914489

IUPACN-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine
SMILESC=CNC1=NCCC=C1CC
InChIInChI=1S/C9H14N2/c1-3-8-6-5-7-11-9(8)10-4-2/h4,6H,2-3,5,7H2,1H3,(H,10,11)
InChIKeyYSLXDRJVTQSLHU-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.86
Rot. Bonds2

About N-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine

N-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine (PubChem CID 123914489) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is N-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine.

Molecular Properties

Compound NameN-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine
PubChem CID123914489
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC NameN-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine
SMILESC=CNC1=NCCC=C1CC
InChIInChI=1S/C9H14N2/c1-3-8-6-5-7-11-9(8)10-4-2/h4,6H,2-3,5,7H2,1H3,(H,10,11)
InChIKeyYSLXDRJVTQSLHU-UHFFFAOYSA-N
XLogP1.86
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine 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-5-ethyl-2,3-dihydropyridin-6-amine?
The IUPAC name of N-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine (CID 123914489) is N-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine.
What is the SMILES notation for N-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine?
The canonical SMILES for N-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine is C=CNC1=NCCC=C1CC.
What is the InChIKey of N-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine?
The InChIKey is YSLXDRJVTQSLHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-3-8-6-5-7-11-9(8)10-4-2/h4,6H,2-3,5,7H2,1H3,(H,10,11).
What are the key properties of N-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine?
N-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine has a molecular weight of 150.22 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-5-ethyl-2,3-dihydropyridin-6-amine is sourced from PubChem (CID 123914489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).