3-[2-(methoxymethyl)phenyl]pyrazin-2-amine

C12H13N3O — CID 112559107

IUPAC3-[2-(methoxymethyl)phenyl]pyrazin-2-amine
SMILESCOCc1ccccc1-c1nccnc1N
InChIInChI=1S/C12H13N3O/c1-16-8-9-4-2-3-5-10(9)11-12(13)15-7-6-14-11/h2-7H,8H2,1H3,(H2,13,15)
InChIKeyZUTOGGJAJBEOCV-UHFFFAOYSA-N
MW215.26 g/mol
LogP1.87
Rot. Bonds3

About 3-[2-(methoxymethyl)phenyl]pyrazin-2-amine

3-[2-(methoxymethyl)phenyl]pyrazin-2-amine (PubChem CID 112559107) has the molecular formula C12H13N3O and a molecular weight of 215.26 g/mol. Its IUPAC name is 3-[2-(methoxymethyl)phenyl]pyrazin-2-amine.

Molecular Properties

Compound Name3-[2-(methoxymethyl)phenyl]pyrazin-2-amine
PubChem CID112559107
Molecular FormulaC12H13N3O
Molecular Weight215.26 g/mol
Exact Mass215.11
IUPAC Name3-[2-(methoxymethyl)phenyl]pyrazin-2-amine
SMILESCOCc1ccccc1-c1nccnc1N
InChIInChI=1S/C12H13N3O/c1-16-8-9-4-2-3-5-10(9)11-12(13)15-7-6-14-11/h2-7H,8H2,1H3,(H2,13,15)
InChIKeyZUTOGGJAJBEOCV-UHFFFAOYSA-N
XLogP1.87
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-(methoxymethyl)phenyl]pyridine-2,6-diamine;hydrochloride
CID 156692785
4-[2-(methoxymethyl)phenyl]-1-methylpyrazol-5-amine
CID 117309638
4-[2-(methoxymethyl)phenyl]-1,3-thiazol-2-amine
CID 162386865
5-[2-(methoxymethyl)phenyl]-3-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-amine
CID 59472374
1-(chloromethyl)-2-[2-(methoxymethyl)phenyl]benzene
CID 139783767
2-(4-chlorophenyl)-3-(methoxymethyl)pyridine
CID 59165700
8-chloro-2-[2-(methoxymethyl)phenyl]imidazo[1,2-a]pyridin-3-amine
CID 103094947
2-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazole
CID 82241061
2-[2-(methoxymethyl)phenyl]benzamide
CID 130398791
1-fluoro-4-[2-(methoxymethyl)phenyl]benzene
CID 59165552
2-(3-methoxypyrazin-2-yl)aniline
CID 104516148
2-methoxy-3-(methoxymethyl)pyridine
CID 67266398

Frequently Asked Questions

What is the IUPAC name of 3-[2-(methoxymethyl)phenyl]pyrazin-2-amine?
The IUPAC name of 3-[2-(methoxymethyl)phenyl]pyrazin-2-amine (CID 112559107) is 3-[2-(methoxymethyl)phenyl]pyrazin-2-amine.
What is the SMILES notation for 3-[2-(methoxymethyl)phenyl]pyrazin-2-amine?
The canonical SMILES for 3-[2-(methoxymethyl)phenyl]pyrazin-2-amine is COCc1ccccc1-c1nccnc1N.
What is the InChIKey of 3-[2-(methoxymethyl)phenyl]pyrazin-2-amine?
The InChIKey is ZUTOGGJAJBEOCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O/c1-16-8-9-4-2-3-5-10(9)11-12(13)15-7-6-14-11/h2-7H,8H2,1H3,(H2,13,15).
What are the key properties of 3-[2-(methoxymethyl)phenyl]pyrazin-2-amine?
3-[2-(methoxymethyl)phenyl]pyrazin-2-amine has a molecular weight of 215.26 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(methoxymethyl)phenyl]pyrazin-2-amine is sourced from PubChem (CID 112559107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).