3-(3-ethoxyphenoxy)pyrazin-2-amine

C12H13N3O2 — CID 102988136

IUPAC3-(3-ethoxyphenoxy)pyrazin-2-amine
SMILESCCOc1cccc(Oc2nccnc2N)c1
InChIInChI=1S/C12H13N3O2/c1-2-16-9-4-3-5-10(8-9)17-12-11(13)14-6-7-15-12/h3-8H,2H2,1H3,(H2,13,14)
InChIKeyYDEDUZQGGGCJMA-UHFFFAOYSA-N
MW231.25 g/mol
LogP2.25
Rot. Bonds4

About 3-(3-ethoxyphenoxy)pyrazin-2-amine

3-(3-ethoxyphenoxy)pyrazin-2-amine (PubChem CID 102988136) has the molecular formula C12H13N3O2 and a molecular weight of 231.25 g/mol. Its IUPAC name is 3-(3-ethoxyphenoxy)pyrazin-2-amine.

Molecular Properties

Compound Name3-(3-ethoxyphenoxy)pyrazin-2-amine
PubChem CID102988136
Molecular FormulaC12H13N3O2
Molecular Weight231.25 g/mol
Exact Mass231.10
IUPAC Name3-(3-ethoxyphenoxy)pyrazin-2-amine
SMILESCCOc1cccc(Oc2nccnc2N)c1
InChIInChI=1S/C12H13N3O2/c1-2-16-9-4-3-5-10(8-9)17-12-11(13)14-6-7-15-12/h3-8H,2H2,1H3,(H2,13,14)
InChIKeyYDEDUZQGGGCJMA-UHFFFAOYSA-N
XLogP2.25
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(3-ethoxyphenoxy)quinoxalin-2-amine
CID 102988134
3-(3-ethoxyphenoxy)pyrazine-2-carboximidamide
CID 62684399
3-bromo-2-(3-ethoxyphenoxy)-4-methylpyridine
CID 106877996
3-ethoxypyrazin-2-amine
CID 13416935
2-(3-ethoxyphenoxy)pyrimidin-5-amine
CID 55060800
5-bromo-6-(3-ethoxyphenoxy)-4-methylpyridin-3-amine
CID 104507343
5-amino-2-(3-ethoxyphenoxy)pyridine-3-carbonitrile
CID 62338626
5-amino-6-(3-ethoxyphenoxy)pyridine-2-carboxylic acid
CID 114408919
3-(3-ethoxyphenoxy)-5-methoxyaniline
CID 80748304
[2-(3-ethoxyphenoxy)-6-methyl-3-pyridinyl]methanamine
CID 62337446
1-[2-(3-ethoxyphenoxy)phenyl]propan-1-amine
CID 115995673
3-chloro-4-(3-ethoxyphenoxy)-1,2,5-thiadiazole
CID 62335962

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethoxyphenoxy)pyrazin-2-amine?
The IUPAC name of 3-(3-ethoxyphenoxy)pyrazin-2-amine (CID 102988136) is 3-(3-ethoxyphenoxy)pyrazin-2-amine.
What is the SMILES notation for 3-(3-ethoxyphenoxy)pyrazin-2-amine?
The canonical SMILES for 3-(3-ethoxyphenoxy)pyrazin-2-amine is CCOc1cccc(Oc2nccnc2N)c1.
What is the InChIKey of 3-(3-ethoxyphenoxy)pyrazin-2-amine?
The InChIKey is YDEDUZQGGGCJMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2/c1-2-16-9-4-3-5-10(8-9)17-12-11(13)14-6-7-15-12/h3-8H,2H2,1H3,(H2,13,14).
What are the key properties of 3-(3-ethoxyphenoxy)pyrazin-2-amine?
3-(3-ethoxyphenoxy)pyrazin-2-amine has a molecular weight of 231.25 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethoxyphenoxy)pyrazin-2-amine is sourced from PubChem (CID 102988136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).