1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine

C13H15N3O — CID 114077969

IUPAC1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine
SMILESCNCc1cc(OC)ccc1-c1cnccn1
InChIInChI=1S/C13H15N3O/c1-14-8-10-7-11(17-2)3-4-12(10)13-9-15-5-6-16-13/h3-7,9,14H,8H2,1-2H3
InChIKeyOLYAHHHQSQDAAR-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.87
Rot. Bonds4

About 1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine

1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine (PubChem CID 114077969) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine
PubChem CID114077969
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine
SMILESCNCc1cc(OC)ccc1-c1cnccn1
InChIInChI=1S/C13H15N3O/c1-14-8-10-7-11(17-2)3-4-12(10)13-9-15-5-6-16-13/h3-7,9,14H,8H2,1-2H3
InChIKeyOLYAHHHQSQDAAR-UHFFFAOYSA-N
XLogP1.87
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-2-pyrazin-2-ylbenzaldehyde
CID 22216617
1-(2-ethoxy-5-methoxyphenyl)-N-methylmethanamine
CID 43276259
2-(2-methoxy-4-propan-2-yloxyphenyl)pyrazine
CID 22249015
N-[(2,4-dimethoxyphenyl)methyl]pyrazin-2-amine
CID 60966861
1-(2,4-dimethoxyphenyl)-N-methyl-1-pyrazin-2-ylmethanamine
CID 62801136
4-(2,4-dimethoxyphenyl)-2-pyrazin-2-yl-1,3-thiazole
CID 60529099
2-[(E)-2-(2-ethyl-4-methoxyphenyl)ethenyl]pyrazine
CID 167858045
3-ethyl-4-pyrazin-2-ylaniline
CID 143125542
N-[(3-methoxyphenyl)methyl]-5-pyrazin-2-yl-4-thiophen-2-ylpyrimidin-2-amine
CID 95800143
2-[4-methoxy-2-(methylaminomethyl)phenoxy]-N-methylacetamide
CID 43276291
[5-methoxy-2-(4-phenoxy-2-pyridinyl)phenyl]methanol
CID 58401719
N-[(2-methoxy-5-pyrazin-2-ylphenyl)methyl]propan-2-amine
CID 63970454

Frequently Asked Questions

What is the IUPAC name of 1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine (CID 114077969) is 1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine is CNCc1cc(OC)ccc1-c1cnccn1.
What is the InChIKey of 1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine?
The InChIKey is OLYAHHHQSQDAAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-14-8-10-7-11(17-2)3-4-12(10)13-9-15-5-6-16-13/h3-7,9,14H,8H2,1-2H3.
What are the key properties of 1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine?
1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine has a molecular weight of 229.28 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methoxy-2-pyrazin-2-ylphenyl)-N-methylmethanamine is sourced from PubChem (CID 114077969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).