6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine

C11H15N5O — CID 75522202

IUPAC6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine
SMILESCCOc1cncc(NCCn2ccnc2)n1
InChIInChI=1S/C11H15N5O/c1-2-17-11-8-13-7-10(15-11)14-4-6-16-5-3-12-9-16/h3,5,7-9H,2,4,6H2,1H3,(H,14,15)
InChIKeyAYHGBKHYEJDJTM-UHFFFAOYSA-N
MW233.28 g/mol
LogP1.18
Rot. Bonds6

About 6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine

6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine (PubChem CID 75522202) has the molecular formula C11H15N5O and a molecular weight of 233.28 g/mol. Its IUPAC name is 6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine.

Molecular Properties

Compound Name6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine
PubChem CID75522202
Molecular FormulaC11H15N5O
Molecular Weight233.28 g/mol
Exact Mass233.13
IUPAC Name6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine
SMILESCCOc1cncc(NCCn2ccnc2)n1
InChIInChI=1S/C11H15N5O/c1-2-17-11-8-13-7-10(15-11)14-4-6-16-5-3-12-9-16/h3,5,7-9H,2,4,6H2,1H3,(H,14,15)
InChIKeyAYHGBKHYEJDJTM-UHFFFAOYSA-N
XLogP1.18
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine?
The IUPAC name of 6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine (CID 75522202) is 6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine.
What is the SMILES notation for 6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine?
The canonical SMILES for 6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine is CCOc1cncc(NCCn2ccnc2)n1.
What is the InChIKey of 6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine?
The InChIKey is AYHGBKHYEJDJTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-2-17-11-8-13-7-10(15-11)14-4-6-16-5-3-12-9-16/h3,5,7-9H,2,4,6H2,1H3,(H,14,15).
What are the key properties of 6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine?
6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine has a molecular weight of 233.28 g/mol, XLogP of 1.18, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-N-(2-imidazol-1-ylethyl)pyrazin-2-amine is sourced from PubChem (CID 75522202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).