2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine

C12H20N2O — CID 79574743

IUPAC2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine
SMILESCCNC(COCC)c1cccc(C)n1
InChIInChI=1S/C12H20N2O/c1-4-13-12(9-15-5-2)11-8-6-7-10(3)14-11/h6-8,12-13H,4-5,9H2,1-3H3
InChIKeyCMAZWTSHRCVFAW-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.08
Rot. Bonds6

About 2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine

2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine (PubChem CID 79574743) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine
PubChem CID79574743
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine
SMILESCCNC(COCC)c1cccc(C)n1
InChIInChI=1S/C12H20N2O/c1-4-13-12(9-15-5-2)11-8-6-7-10(3)14-11/h6-8,12-13H,4-5,9H2,1-3H3
InChIKeyCMAZWTSHRCVFAW-UHFFFAOYSA-N
XLogP2.08
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine?
The IUPAC name of 2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine (CID 79574743) is 2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine.
What is the SMILES notation for 2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine?
The canonical SMILES for 2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine is CCNC(COCC)c1cccc(C)n1.
What is the InChIKey of 2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine?
The InChIKey is CMAZWTSHRCVFAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-4-13-12(9-15-5-2)11-8-6-7-10(3)14-11/h6-8,12-13H,4-5,9H2,1-3H3.
What are the key properties of 2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine?
2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine has a molecular weight of 208.30 g/mol, XLogP of 2.08, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine is sourced from PubChem (CID 79574743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).