6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine

C12H20N2O2 — CID 115922413

IUPAC6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine
SMILESCCOCC(C)Nc1ccc(OCC)nc1
InChIInChI=1S/C12H20N2O2/c1-4-15-9-10(3)14-11-6-7-12(13-8-11)16-5-2/h6-8,10,14H,4-5,9H2,1-3H3
InChIKeyKESLYWNUHYBGDZ-UHFFFAOYSA-N
MW224.30 g/mol
LogP2.32
Rot. Bonds7

About 6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine

6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine (PubChem CID 115922413) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine.

Molecular Properties

Compound Name6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine
PubChem CID115922413
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine
SMILESCCOCC(C)Nc1ccc(OCC)nc1
InChIInChI=1S/C12H20N2O2/c1-4-15-9-10(3)14-11-6-7-12(13-8-11)16-5-2/h6-8,10,14H,4-5,9H2,1-3H3
InChIKeyKESLYWNUHYBGDZ-UHFFFAOYSA-N
XLogP2.32
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine?
The IUPAC name of 6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine (CID 115922413) is 6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine.
What is the SMILES notation for 6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine?
The canonical SMILES for 6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine is CCOCC(C)Nc1ccc(OCC)nc1.
What is the InChIKey of 6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine?
The InChIKey is KESLYWNUHYBGDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-4-15-9-10(3)14-11-6-7-12(13-8-11)16-5-2/h6-8,10,14H,4-5,9H2,1-3H3.
What are the key properties of 6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine?
6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine has a molecular weight of 224.30 g/mol, XLogP of 2.32, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-N-(1-ethoxypropan-2-yl)pyridin-3-amine is sourced from PubChem (CID 115922413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).