6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine

C15H19N3O — CID 102908736

IUPAC6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine
SMILESCNc1cccc(Nc2ccccc2CCOC)n1
InChIInChI=1S/C15H19N3O/c1-16-14-8-5-9-15(18-14)17-13-7-4-3-6-12(13)10-11-19-2/h3-9H,10-11H2,1-2H3,(H2,16,17,18)
InChIKeyAEDAVCFDIATMKB-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.06
Rot. Bonds6

About 6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine

6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine (PubChem CID 102908736) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine
PubChem CID102908736
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine
SMILESCNc1cccc(Nc2ccccc2CCOC)n1
InChIInChI=1S/C15H19N3O/c1-16-14-8-5-9-15(18-14)17-13-7-4-3-6-12(13)10-11-19-2/h3-9H,10-11H2,1-2H3,(H2,16,17,18)
InChIKeyAEDAVCFDIATMKB-UHFFFAOYSA-N
XLogP3.06
TPSA46.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-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 6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine?
The IUPAC name of 6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine (CID 102908736) is 6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine.
What is the SMILES notation for 6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine?
The canonical SMILES for 6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine is CNc1cccc(Nc2ccccc2CCOC)n1.
What is the InChIKey of 6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine?
The InChIKey is AEDAVCFDIATMKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-16-14-8-5-9-15(18-14)17-13-7-4-3-6-12(13)10-11-19-2/h3-9H,10-11H2,1-2H3,(H2,16,17,18).
What are the key properties of 6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine?
6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine has a molecular weight of 257.34 g/mol, XLogP of 3.06, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-[2-(2-methoxyethyl)phenyl]-2-N-methylpyridine-2,6-diamine is sourced from PubChem (CID 102908736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).