5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine

C8H15N3 — CID 167203549

IUPAC5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine
SMILESCCC1=C(N)N=CC(NC)C1
InChIInChI=1S/C8H15N3/c1-3-6-4-7(10-2)5-11-8(6)9/h5,7,10H,3-4,9H2,1-2H3
InChIKeyRGECUGYVKFHJFW-UHFFFAOYSA-N
MW153.23 g/mol
LogP0.63
Rot. Bonds2

About 5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine

5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine (PubChem CID 167203549) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine.

Molecular Properties

Compound Name5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine
PubChem CID167203549
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine
SMILESCCC1=C(N)N=CC(NC)C1
InChIInChI=1S/C8H15N3/c1-3-6-4-7(10-2)5-11-8(6)9/h5,7,10H,3-4,9H2,1-2H3
InChIKeyRGECUGYVKFHJFW-UHFFFAOYSA-N
XLogP0.63
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine 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

2-methyl-2,3,4,5-tetrahydro-1H-pyrrolo[2,3-b]pyridine
CID 117795444
1-(3,4-dihydropyridin-5-yl)-N-methylpropan-1-amine
CID 142884393
N-cyclopropyl-5-methyl-3,4-dihydropyridin-6-amine
CID 145551366
2-(3,4-dihydropyridin-5-yl)-N-methylethanamine
CID 143587089
5-Methyl-6-(propan-2-ylideneamino)-3,4-dihydropyridin-3-amine
CID 144015516
N-methyl-1-(3H-pyrrol-4-yl)propan-2-amine
CID 158084301

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine?
The IUPAC name of 5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine (CID 167203549) is 5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine.
What is the SMILES notation for 5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine?
The canonical SMILES for 5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine is CCC1=C(N)N=CC(NC)C1.
What is the InChIKey of 5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine?
The InChIKey is RGECUGYVKFHJFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-3-6-4-7(10-2)5-11-8(6)9/h5,7,10H,3-4,9H2,1-2H3.
What are the key properties of 5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine?
5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine has a molecular weight of 153.23 g/mol, XLogP of 0.63, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-N-methyl-3,4-dihydropyridine-3,6-diamine is sourced from PubChem (CID 167203549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).