2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine

C9H15N3O — CID 104516755

IUPAC2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine
SMILESCOc1nccnc1C(C)(C)CN
InChIInChI=1S/C9H15N3O/c1-9(2,6-10)7-8(13-3)12-5-4-11-7/h4-5H,6,10H2,1-3H3
InChIKeyRYNZUWWVFAJTTD-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.72
Rot. Bonds3

About 2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine

2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine (PubChem CID 104516755) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine
PubChem CID104516755
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine
SMILESCOc1nccnc1C(C)(C)CN
InChIInChI=1S/C9H15N3O/c1-9(2,6-10)7-8(13-3)12-5-4-11-7/h4-5H,6,10H2,1-3H3
InChIKeyRYNZUWWVFAJTTD-UHFFFAOYSA-N
XLogP0.72
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3-methoxypyrazin-2-yl)-4-methylpentan-2-one
CID 104516378
2-(2-methoxy-3-pyridinyl)-2-methylpropan-1-amine
CID 130543295
3-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine
CID 104516794
2-(3-methoxypyrazin-2-yl)-N-methylpropan-2-amine
CID 175976338
4-fluoro-5-methoxy-4-(3-methoxypyrazin-2-yl)pentan-1-amine
CID 103392369
1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine
CID 104514796
1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine
CID 114833857
1-(3-methoxypyrazin-2-yl)-1-phenylethanol
CID 113421421
2-isoquinolin-1-yl-2-methylpropan-1-amine
CID 116995215
3-amino-1,1,1-trifluoro-2-(3-methoxypyrazin-2-yl)butan-2-ol
CID 113421686
1-(2-methoxyphenyl)-1-(3-methoxypyrazin-2-yl)ethanol
CID 104514450
1-(2-bromophenyl)-1-(3-methoxypyrazin-2-yl)ethanol
CID 113421425

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine?
The IUPAC name of 2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine (CID 104516755) is 2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine.
What is the SMILES notation for 2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine?
The canonical SMILES for 2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine is COc1nccnc1C(C)(C)CN.
What is the InChIKey of 2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine?
The InChIKey is RYNZUWWVFAJTTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-9(2,6-10)7-8(13-3)12-5-4-11-7/h4-5H,6,10H2,1-3H3.
What are the key properties of 2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine?
2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine has a molecular weight of 181.24 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine is sourced from PubChem (CID 104516755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).