[6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine

C11H19N3O3 — CID 103180853

IUPAC[6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine
SMILESCOCCCOCCOc1cncc(CN)n1
InChIInChI=1S/C11H19N3O3/c1-15-3-2-4-16-5-6-17-11-9-13-8-10(7-12)14-11/h8-9H,2-7,12H2,1H3
InChIKeyUDUROGBRYCXTJU-UHFFFAOYSA-N
MW241.29 g/mol
LogP0.37
Rot. Bonds9

About [6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine

[6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine (PubChem CID 103180853) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is [6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine.

Molecular Properties

Compound Name[6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine
PubChem CID103180853
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name[6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine
SMILESCOCCCOCCOc1cncc(CN)n1
InChIInChI=1S/C11H19N3O3/c1-15-3-2-4-16-5-6-17-11-9-13-8-10(7-12)14-11/h8-9H,2-7,12H2,1H3
InChIKeyUDUROGBRYCXTJU-UHFFFAOYSA-N
XLogP0.37
TPSA79.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-[2-(3-methoxypropoxy)ethoxy]-N-methylpyrazin-2-amine
CID 103176525
6-[2-(3-methoxypropoxy)ethoxy]-N-propylpyrazin-2-amine
CID 103176484
(6-ethoxypyrazin-2-yl)methanamine
CID 66450583
[2-[2-(3-methoxypropoxy)ethoxy]-4,6-dimethyl-3-pyridinyl]methanamine
CID 103176709
6-[2-(3-methoxypropoxy)ethoxy]pyridin-3-amine
CID 103176771
[6-[3-(2-methoxyethoxy)propoxy]pyridazin-3-yl]methanamine
CID 103405953
N-[[6-(2-butoxyethoxy)pyrazin-2-yl]methyl]propan-1-amine
CID 66451575
N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine
CID 113325024
5-[2-(3-methoxypropoxy)ethoxy]pyridin-3-amine
CID 103176470
[2-[2-(3-methoxypropoxy)ethoxy]-6-propan-2-yl-4-pyridinyl]methanamine
CID 103180842
N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-methylcyclopropanamine
CID 102740601
[3-[2-(3-methoxypropoxy)ethoxy]-4-pyridinyl]methanamine
CID 103176702

Frequently Asked Questions

What is the IUPAC name of [6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine?
The IUPAC name of [6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine (CID 103180853) is [6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine.
What is the SMILES notation for [6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine?
The canonical SMILES for [6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine is COCCCOCCOc1cncc(CN)n1.
What is the InChIKey of [6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine?
The InChIKey is UDUROGBRYCXTJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-15-3-2-4-16-5-6-17-11-9-13-8-10(7-12)14-11/h8-9H,2-7,12H2,1H3.
What are the key properties of [6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine?
[6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine has a molecular weight of 241.29 g/mol, XLogP of 0.37, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[2-(3-methoxypropoxy)ethoxy]pyrazin-2-yl]methanamine is sourced from PubChem (CID 103180853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).