1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine

C11H19N3O3 — CID 107946647

IUPAC1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine
SMILESCCCOCC(N)c1ncc(OC)nc1OC
InChIInChI=1S/C11H19N3O3/c1-4-5-17-7-8(12)10-11(16-3)14-9(15-2)6-13-10/h6,8H,4-5,7,12H2,1-3H3
InChIKeyOYMNKRJJMRDBKC-UHFFFAOYSA-N
MW241.29 g/mol
LogP0.92
Rot. Bonds7

About 1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine

1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine (PubChem CID 107946647) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is 1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine.

Molecular Properties

Compound Name1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine
PubChem CID107946647
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine
SMILESCCCOCC(N)c1ncc(OC)nc1OC
InChIInChI=1S/C11H19N3O3/c1-4-5-17-7-8(12)10-11(16-3)14-9(15-2)6-13-10/h6,8H,4-5,7,12H2,1-3H3
InChIKeyOYMNKRJJMRDBKC-UHFFFAOYSA-N
XLogP0.92
TPSA79.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(3,5-dimethoxypyrazin-2-yl)-N-ethyl-2-propoxyethanamine
CID 107946650
[1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine
CID 105332275
1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 103216134
1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoropropan-1-amine
CID 114983788
1-(3,5-dimethoxypyrazin-2-yl)-2-pyridin-4-ylethanamine
CID 105178270
1-(3,5-dimethoxypyrazin-2-yl)-2-(3-methoxyphenyl)ethanamine
CID 105030849
1-(3,5-dimethoxypyrazin-2-yl)-2-methylpropan-1-amine
CID 105031303
1-(3,5-dimethoxypyrazin-2-yl)-2,2-difluoroethanamine
CID 103517039
1-(3,5-dimethoxypyrazin-2-yl)-2-methoxy-N-methylethanamine
CID 105178224
1-(3,5-dimethoxypyrazin-2-yl)-2-methoxypropan-1-amine
CID 105178309
1-(3,5-dimethoxypyrazin-2-yl)-4-thiophen-2-ylbutan-1-amine
CID 105178245
1-(3,5-dichloro-2-pyridinyl)-2-propoxyethanamine
CID 79780789

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine?
The IUPAC name of 1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine (CID 107946647) is 1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine.
What is the SMILES notation for 1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine?
The canonical SMILES for 1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine is CCCOCC(N)c1ncc(OC)nc1OC.
What is the InChIKey of 1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine?
The InChIKey is OYMNKRJJMRDBKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-4-5-17-7-8(12)10-11(16-3)14-9(15-2)6-13-10/h6,8H,4-5,7,12H2,1-3H3.
What are the key properties of 1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine?
1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine has a molecular weight of 241.29 g/mol, XLogP of 0.92, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine is sourced from PubChem (CID 107946647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).