5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine

C11H19N3O — CID 156651791

IUPAC5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine
SMILESCCCN(CCOC)c1ccc(N)nc1
InChIInChI=1S/C11H19N3O/c1-3-6-14(7-8-15-2)10-4-5-11(12)13-9-10/h4-5,9H,3,6-8H2,1-2H3,(H2,12,13)
InChIKeyMEZCLKNDLQFFQR-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.53
Rot. Bonds6

About 5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine

5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine (PubChem CID 156651791) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine.

Molecular Properties

Compound Name5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine
PubChem CID156651791
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine
SMILESCCCN(CCOC)c1ccc(N)nc1
InChIInChI=1S/C11H19N3O/c1-3-6-14(7-8-15-2)10-4-5-11(12)13-9-10/h4-5,9H,3,6-8H2,1-2H3,(H2,12,13)
InChIKeyMEZCLKNDLQFFQR-UHFFFAOYSA-N
XLogP1.53
TPSA51.38 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 ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine?
The IUPAC name of 5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine (CID 156651791) is 5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine.
What is the SMILES notation for 5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine?
The canonical SMILES for 5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine is CCCN(CCOC)c1ccc(N)nc1.
What is the InChIKey of 5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine?
The InChIKey is MEZCLKNDLQFFQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-3-6-14(7-8-15-2)10-4-5-11(12)13-9-10/h4-5,9H,3,6-8H2,1-2H3,(H2,12,13).
What are the key properties of 5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine?
5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine has a molecular weight of 209.29 g/mol, XLogP of 1.53, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine is sourced from PubChem (CID 156651791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).