6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine

C11H19N3O — CID 80809532

IUPAC6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine
SMILESCCN(CCOC)c1cccc(NC)n1
InChIInChI=1S/C11H19N3O/c1-4-14(8-9-15-3)11-7-5-6-10(12-2)13-11/h5-7H,4,8-9H2,1-3H3,(H,12,13)
InChIKeyHPEINYTWPIJLAZ-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.60
Rot. Bonds6

About 6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine

6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine (PubChem CID 80809532) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine
PubChem CID80809532
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine
SMILESCCN(CCOC)c1cccc(NC)n1
InChIInChI=1S/C11H19N3O/c1-4-14(8-9-15-3)11-7-5-6-10(12-2)13-11/h5-7H,4,8-9H2,1-3H3,(H,12,13)
InChIKeyHPEINYTWPIJLAZ-UHFFFAOYSA-N
XLogP1.60
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine?
The IUPAC name of 6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine (CID 80809532) is 6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine.
What is the SMILES notation for 6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine?
The canonical SMILES for 6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine is CCN(CCOC)c1cccc(NC)n1.
What is the InChIKey of 6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine?
The InChIKey is HPEINYTWPIJLAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-4-14(8-9-15-3)11-7-5-6-10(12-2)13-11/h5-7H,4,8-9H2,1-3H3,(H,12,13).
What are the key properties of 6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine?
6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine has a molecular weight of 209.29 g/mol, XLogP of 1.60, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine is sourced from PubChem (CID 80809532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).