3,5-dichloro-6-N-ethylpyridine-2,6-diamine

C7H9Cl2N3 — CID 102755516

IUPAC3,5-dichloro-6-N-ethylpyridine-2,6-diamine
SMILESCCNc1nc(N)c(Cl)cc1Cl
InChIInChI=1S/C7H9Cl2N3/c1-2-11-7-5(9)3-4(8)6(10)12-7/h3H,2H2,1H3,(H3,10,11,12)
InChIKeyIMLRQTYQZJJJLU-UHFFFAOYSA-N
MW206.08 g/mol
LogP2.40
Rot. Bonds2

About 3,5-dichloro-6-N-ethylpyridine-2,6-diamine

3,5-dichloro-6-N-ethylpyridine-2,6-diamine (PubChem CID 102755516) has the molecular formula C7H9Cl2N3 and a molecular weight of 206.08 g/mol. Its IUPAC name is 3,5-dichloro-6-N-ethylpyridine-2,6-diamine.

Molecular Properties

Compound Name3,5-dichloro-6-N-ethylpyridine-2,6-diamine
PubChem CID102755516
Molecular FormulaC7H9Cl2N3
Molecular Weight206.08 g/mol
Exact Mass205.02
IUPAC Name3,5-dichloro-6-N-ethylpyridine-2,6-diamine
SMILESCCNc1nc(N)c(Cl)cc1Cl
InChIInChI=1S/C7H9Cl2N3/c1-2-11-7-5(9)3-4(8)6(10)12-7/h3H,2H2,1H3,(H3,10,11,12)
InChIKeyIMLRQTYQZJJJLU-UHFFFAOYSA-N
XLogP2.40
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.08
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3,5-dichloro-6-N-ethylpyridine-2,6-diamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-N-ethylpyridine-2,6-diamine?
The IUPAC name of 3,5-dichloro-6-N-ethylpyridine-2,6-diamine (CID 102755516) is 3,5-dichloro-6-N-ethylpyridine-2,6-diamine.
What is the SMILES notation for 3,5-dichloro-6-N-ethylpyridine-2,6-diamine?
The canonical SMILES for 3,5-dichloro-6-N-ethylpyridine-2,6-diamine is CCNc1nc(N)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-N-ethylpyridine-2,6-diamine?
The InChIKey is IMLRQTYQZJJJLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9Cl2N3/c1-2-11-7-5(9)3-4(8)6(10)12-7/h3H,2H2,1H3,(H3,10,11,12).
What are the key properties of 3,5-dichloro-6-N-ethylpyridine-2,6-diamine?
3,5-dichloro-6-N-ethylpyridine-2,6-diamine has a molecular weight of 206.08 g/mol, XLogP of 2.40, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-N-ethylpyridine-2,6-diamine is sourced from PubChem (CID 102755516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).