2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine

C11H19N3O2 — CID 116726340

IUPAC2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine
SMILESCCOC(C)(C)C(N)c1nccnc1OC
InChIInChI=1S/C11H19N3O2/c1-5-16-11(2,3)9(12)8-10(15-4)14-7-6-13-8/h6-7,9H,5,12H2,1-4H3
InChIKeyUHDBVDBASUGZFB-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.30
Rot. Bonds5

About 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine

2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine (PubChem CID 116726340) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine
PubChem CID116726340
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine
SMILESCCOC(C)(C)C(N)c1nccnc1OC
InChIInChI=1S/C11H19N3O2/c1-5-16-11(2,3)9(12)8-10(15-4)14-7-6-13-8/h6-7,9H,5,12H2,1-4H3
InChIKeyUHDBVDBASUGZFB-UHFFFAOYSA-N
XLogP1.30
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine?
The IUPAC name of 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine (CID 116726340) is 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine.
What is the SMILES notation for 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine?
The canonical SMILES for 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine is CCOC(C)(C)C(N)c1nccnc1OC.
What is the InChIKey of 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine?
The InChIKey is UHDBVDBASUGZFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-5-16-11(2,3)9(12)8-10(15-4)14-7-6-13-8/h6-7,9H,5,12H2,1-4H3.
What are the key properties of 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine?
2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine has a molecular weight of 225.29 g/mol, XLogP of 1.30, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine is sourced from PubChem (CID 116726340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).