2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine

C11H18N2O — CID 115374703

IUPAC2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
SMILESCCOCC(NC)c1cncc(C)c1
InChIInChI=1S/C11H18N2O/c1-4-14-8-11(12-3)10-5-9(2)6-13-7-10/h5-7,11-12H,4,8H2,1-3H3
InChIKeyPLULODGQDBYXJC-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.69
Rot. Bonds5

About 2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine

2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine (PubChem CID 115374703) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
PubChem CID115374703
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
SMILESCCOCC(NC)c1cncc(C)c1
InChIInChI=1S/C11H18N2O/c1-4-14-8-11(12-3)10-5-9(2)6-13-7-10/h5-7,11-12H,4,8H2,1-3H3
InChIKeyPLULODGQDBYXJC-UHFFFAOYSA-N
XLogP1.69
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine?
The IUPAC name of 2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine (CID 115374703) is 2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine?
The canonical SMILES for 2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine is CCOCC(NC)c1cncc(C)c1.
What is the InChIKey of 2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine?
The InChIKey is PLULODGQDBYXJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-4-14-8-11(12-3)10-5-9(2)6-13-7-10/h5-7,11-12H,4,8H2,1-3H3.
What are the key properties of 2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine?
2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine has a molecular weight of 194.28 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 115374703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).