1-(3-methoxypyrazin-2-yl)ethanamine

C7H11N3O — CID 119094858

IUPAC1-(3-methoxypyrazin-2-yl)ethanamine
SMILESCOc1nccnc1C(C)N
InChIInChI=1S/C7H11N3O/c1-5(8)6-7(11-2)10-4-3-9-6/h3-5H,8H2,1-2H3
InChIKeyYJINZKSXFXTODQ-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.50
Rot. Bonds2

About 1-(3-methoxypyrazin-2-yl)ethanamine

1-(3-methoxypyrazin-2-yl)ethanamine (PubChem CID 119094858) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is 1-(3-methoxypyrazin-2-yl)ethanamine.

Molecular Properties

Compound Name1-(3-methoxypyrazin-2-yl)ethanamine
PubChem CID119094858
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name1-(3-methoxypyrazin-2-yl)ethanamine
SMILESCOc1nccnc1C(C)N
InChIInChI=1S/C7H11N3O/c1-5(8)6-7(11-2)10-4-3-9-6/h3-5H,8H2,1-2H3
InChIKeyYJINZKSXFXTODQ-UHFFFAOYSA-N
XLogP0.50
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxypyrazin-2-yl)ethanamine?
The IUPAC name of 1-(3-methoxypyrazin-2-yl)ethanamine (CID 119094858) is 1-(3-methoxypyrazin-2-yl)ethanamine.
What is the SMILES notation for 1-(3-methoxypyrazin-2-yl)ethanamine?
The canonical SMILES for 1-(3-methoxypyrazin-2-yl)ethanamine is COc1nccnc1C(C)N.
What is the InChIKey of 1-(3-methoxypyrazin-2-yl)ethanamine?
The InChIKey is YJINZKSXFXTODQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-5(8)6-7(11-2)10-4-3-9-6/h3-5H,8H2,1-2H3.
What are the key properties of 1-(3-methoxypyrazin-2-yl)ethanamine?
1-(3-methoxypyrazin-2-yl)ethanamine has a molecular weight of 153.18 g/mol, XLogP of 0.50, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxypyrazin-2-yl)ethanamine is sourced from PubChem (CID 119094858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).