[3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine

C14H17N3O2 — CID 103568182

IUPAC[3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine
SMILESCOc1cc(CN)cc(Oc2cnc(C)c(C)n2)c1
InChIInChI=1S/C14H17N3O2/c1-9-10(2)17-14(8-16-9)19-13-5-11(7-15)4-12(6-13)18-3/h4-6,8H,7,15H2,1-3H3
InChIKeyQOWXWMVPXYREOP-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.35
Rot. Bonds4

About [3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine

[3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine (PubChem CID 103568182) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is [3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine.

Molecular Properties

Compound Name[3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine
PubChem CID103568182
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name[3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine
SMILESCOc1cc(CN)cc(Oc2cnc(C)c(C)n2)c1
InChIInChI=1S/C14H17N3O2/c1-9-10(2)17-14(8-16-9)19-13-5-11(7-15)4-12(6-13)18-3/h4-6,8H,7,15H2,1-3H3
InChIKeyQOWXWMVPXYREOP-UHFFFAOYSA-N
XLogP2.35
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[3-(5-chloropyrimidin-2-yl)oxy-5-methoxyphenyl]methanamine
CID 103568226
[3-(5-bromo-4-methoxypyrimidin-2-yl)oxy-5-methoxyphenyl]methanamine
CID 106999557
4-[3-(aminomethyl)-5-methoxyphenoxy]-2-propan-2-yl-1H-pyrimidin-6-one
CID 103568180
[3-[(3-bromo-5-chloro-2-pyridinyl)oxy]-5-methoxyphenyl]methanamine
CID 103568187
[3-(2-fluoroethoxy)-5-methoxyphenyl]methanamine
CID 103566052
4-[3-(aminomethyl)-5-methoxyphenoxy]-2-cyclopropyl-1H-pyrimidin-6-one
CID 103568254
[4-(5,6-dimethylpyrazin-2-yl)oxy-3-methoxyphenyl]methanol
CID 107744072
[3-(3-fluoropropoxy)-5-methoxyphenyl]methanamine
CID 103566053
6-[3-(aminomethyl)-5-methoxyphenoxy]-N-methylpyridazine-3-carboxamide
CID 103568225
(3-bromo-5-methoxyphenyl)methanamine
CID 53414441
(3-chloro-5-methoxyphenyl)methanamine
CID 51063718
[3-[(3,4-dimethylphenyl)methoxy]-5-methoxyphenyl]methanamine
CID 103566148

Frequently Asked Questions

What is the IUPAC name of [3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine?
The IUPAC name of [3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine (CID 103568182) is [3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine.
What is the SMILES notation for [3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine?
The canonical SMILES for [3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine is COc1cc(CN)cc(Oc2cnc(C)c(C)n2)c1.
What is the InChIKey of [3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine?
The InChIKey is QOWXWMVPXYREOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-9-10(2)17-14(8-16-9)19-13-5-11(7-15)4-12(6-13)18-3/h4-6,8H,7,15H2,1-3H3.
What are the key properties of [3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine?
[3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine has a molecular weight of 259.31 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(5,6-dimethylpyrazin-2-yl)oxy-5-methoxyphenyl]methanamine is sourced from PubChem (CID 103568182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).