2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine

C11H19N3O — CID 115530851

IUPAC2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine
SMILESCCNC(COCC)c1ccnc(C)n1
InChIInChI=1S/C11H19N3O/c1-4-12-11(8-15-5-2)10-6-7-13-9(3)14-10/h6-7,11-12H,4-5,8H2,1-3H3
InChIKeyJCQBGHAHTVFDKB-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.47
Rot. Bonds6

About 2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine

2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine (PubChem CID 115530851) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine.

Molecular Properties

Compound Name2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine
PubChem CID115530851
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine
SMILESCCNC(COCC)c1ccnc(C)n1
InChIInChI=1S/C11H19N3O/c1-4-12-11(8-15-5-2)10-6-7-13-9(3)14-10/h6-7,11-12H,4-5,8H2,1-3H3
InChIKeyJCQBGHAHTVFDKB-UHFFFAOYSA-N
XLogP1.47
TPSA47.04 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 ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-N-ethyl-1-(6-methyl-2-pyridinyl)ethanamine
CID 79574743
N-ethyl-1-(2-methylpyrimidin-4-yl)heptan-1-amine
CID 113329619
N-ethyl-2-(4-iodophenyl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 115530719
N-ethyl-1-(2-methylpyrimidin-4-yl)-3-methylsulfonylpropan-1-amine
CID 115530771
N-ethyl-2-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 113329611
[2-methoxy-1-(2-methylpyrimidin-4-yl)ethyl]hydrazine
CID 105260599
3-[2-(ethylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-4-amine
CID 115530844
2-(5-chloro-2-methoxyphenyl)-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine
CID 115530726
2-(4-bromo-1,3-dimethylpyrazol-5-yl)-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine
CID 115530947
2-(4-chloro-1,3-dimethylpyrazol-5-yl)-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine
CID 115530910
N-ethyl-3-methyl-1-(2-methylpyrimidin-4-yl)but-2-en-1-amine
CID 115530788
2-ethoxy-N-ethyl-1-(2-methylfuran-3-yl)ethanamine
CID 104790093

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine?
The IUPAC name of 2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine (CID 115530851) is 2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine.
What is the SMILES notation for 2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine?
The canonical SMILES for 2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine is CCNC(COCC)c1ccnc(C)n1.
What is the InChIKey of 2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine?
The InChIKey is JCQBGHAHTVFDKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-4-12-11(8-15-5-2)10-6-7-13-9(3)14-10/h6-7,11-12H,4-5,8H2,1-3H3.
What are the key properties of 2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine?
2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine has a molecular weight of 209.29 g/mol, XLogP of 1.47, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-ethyl-1-(2-methylpyrimidin-4-yl)ethanamine is sourced from PubChem (CID 115530851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).