2-[(3-methoxypyrazin-2-yl)amino]ethanol

C7H11N3O2 — CID 130736402

IUPAC2-[(3-methoxypyrazin-2-yl)amino]ethanol
SMILESCOc1nccnc1NCCO
InChIInChI=1S/C7H11N3O2/c1-12-7-6(9-4-5-11)8-2-3-10-7/h2-3,11H,4-5H2,1H3,(H,8,9)
InChIKeyALCAVUNFFXSWAS-UHFFFAOYSA-N
MW169.18 g/mol
LogP-0.11
Rot. Bonds4

About 2-[(3-methoxypyrazin-2-yl)amino]ethanol

2-[(3-methoxypyrazin-2-yl)amino]ethanol (PubChem CID 130736402) has the molecular formula C7H11N3O2 and a molecular weight of 169.18 g/mol. Its IUPAC name is 2-[(3-methoxypyrazin-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(3-methoxypyrazin-2-yl)amino]ethanol
PubChem CID130736402
Molecular FormulaC7H11N3O2
Molecular Weight169.18 g/mol
Exact Mass169.09
IUPAC Name2-[(3-methoxypyrazin-2-yl)amino]ethanol
SMILESCOc1nccnc1NCCO
InChIInChI=1S/C7H11N3O2/c1-12-7-6(9-4-5-11)8-2-3-10-7/h2-3,11H,4-5H2,1H3,(H,8,9)
InChIKeyALCAVUNFFXSWAS-UHFFFAOYSA-N
XLogP-0.11
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-methoxypyrazin-2-yl)amino]ethanol?
The IUPAC name of 2-[(3-methoxypyrazin-2-yl)amino]ethanol (CID 130736402) is 2-[(3-methoxypyrazin-2-yl)amino]ethanol.
What is the SMILES notation for 2-[(3-methoxypyrazin-2-yl)amino]ethanol?
The canonical SMILES for 2-[(3-methoxypyrazin-2-yl)amino]ethanol is COc1nccnc1NCCO.
What is the InChIKey of 2-[(3-methoxypyrazin-2-yl)amino]ethanol?
The InChIKey is ALCAVUNFFXSWAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2/c1-12-7-6(9-4-5-11)8-2-3-10-7/h2-3,11H,4-5H2,1H3,(H,8,9).
What are the key properties of 2-[(3-methoxypyrazin-2-yl)amino]ethanol?
2-[(3-methoxypyrazin-2-yl)amino]ethanol has a molecular weight of 169.18 g/mol, XLogP of -0.11, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxypyrazin-2-yl)amino]ethanol is sourced from PubChem (CID 130736402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).