N-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine

C15H19N3O3 — CID 107381670

IUPACN-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine
SMILESCCNCc1cnc(Oc2c(OC)cccc2OC)cn1
InChIInChI=1S/C15H19N3O3/c1-4-16-8-11-9-18-14(10-17-11)21-15-12(19-2)6-5-7-13(15)20-3/h5-7,9-10,16H,4,8H2,1-3H3
InChIKeyWJYGEAMGLMRTAJ-UHFFFAOYSA-N
MW289.34 g/mol
LogP2.40
Rot. Bonds7

About N-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine

N-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine (PubChem CID 107381670) has the molecular formula C15H19N3O3 and a molecular weight of 289.34 g/mol. Its IUPAC name is N-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine
PubChem CID107381670
Molecular FormulaC15H19N3O3
Molecular Weight289.34 g/mol
Exact Mass289.14
IUPAC NameN-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine
SMILESCCNCc1cnc(Oc2c(OC)cccc2OC)cn1
InChIInChI=1S/C15H19N3O3/c1-4-16-8-11-9-18-14(10-17-11)21-15-12(19-2)6-5-7-13(15)20-3/h5-7,9-10,16H,4,8H2,1-3H3
InChIKeyWJYGEAMGLMRTAJ-UHFFFAOYSA-N
XLogP2.40
TPSA65.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[5-(2,3-dichlorophenoxy)pyrazin-2-yl]methyl]ethanamine
CID 107381649
N-[[5-(2-ethylphenoxy)pyrazin-2-yl]methyl]ethanamine
CID 107382000
N-[[5-(4-methoxyphenoxy)pyrazin-2-yl]methyl]ethanamine
CID 107381915
N-[[5-(2,3,6-trimethylphenoxy)pyrazin-2-yl]methyl]ethanamine
CID 107381985
N-[[5-(3-methoxyphenoxy)pyrazin-2-yl]methyl]propan-1-amine
CID 107381742
N-[[5-(2-fluoro-5-methylphenoxy)pyrazin-2-yl]methyl]ethanamine
CID 107382235
1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 62298293
N-[[5-(2-ethoxyphenoxy)pyrazin-2-yl]methyl]propan-1-amine
CID 107381727
N-[[5-(2,3-difluorophenoxy)pyrazin-2-yl]methyl]propan-1-amine
CID 107382115
N-methyl-1-(5-naphthalen-1-yloxypyrazin-2-yl)methanamine
CID 107381908
N-[[5-(2-fluorophenoxy)pyrazin-2-yl]methyl]propan-1-amine
CID 107381761
N-[[3-methoxy-2-(2-methoxyethoxy)phenyl]methyl]ethanamine
CID 43471950

Frequently Asked Questions

What is the IUPAC name of N-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine?
The IUPAC name of N-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine (CID 107381670) is N-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine.
What is the SMILES notation for N-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine?
The canonical SMILES for N-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine is CCNCc1cnc(Oc2c(OC)cccc2OC)cn1.
What is the InChIKey of N-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine?
The InChIKey is WJYGEAMGLMRTAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-4-16-8-11-9-18-14(10-17-11)21-15-12(19-2)6-5-7-13(15)20-3/h5-7,9-10,16H,4,8H2,1-3H3.
What are the key properties of N-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine?
N-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine has a molecular weight of 289.34 g/mol, XLogP of 2.40, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(2,6-dimethoxyphenoxy)pyrazin-2-yl]methyl]ethanamine is sourced from PubChem (CID 107381670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).