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

C9H15N3O — CID 104515370

IUPAC1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine
SMILESCCC(NC)c1nccnc1OC
InChIInChI=1S/C9H15N3O/c1-4-7(10-2)8-9(13-3)12-6-5-11-8/h5-7,10H,4H2,1-3H3
InChIKeyGOFJRPIPBCHMQJ-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.16
Rot. Bonds4

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

1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine (PubChem CID 104515370) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine
PubChem CID104515370
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine
SMILESCCC(NC)c1nccnc1OC
InChIInChI=1S/C9H15N3O/c1-4-7(10-2)8-9(13-3)12-6-5-11-8/h5-7,10H,4H2,1-3H3
InChIKeyGOFJRPIPBCHMQJ-UHFFFAOYSA-N
XLogP1.16
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine?
The IUPAC name of 1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine (CID 104515370) is 1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine.
What is the SMILES notation for 1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine?
The canonical SMILES for 1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine is CCC(NC)c1nccnc1OC.
What is the InChIKey of 1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine?
The InChIKey is GOFJRPIPBCHMQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-4-7(10-2)8-9(13-3)12-6-5-11-8/h5-7,10H,4H2,1-3H3.
What are the key properties of 1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine?
1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine has a molecular weight of 181.24 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine is sourced from PubChem (CID 104515370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).