[1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine

C12H22N4O3 — CID 105332275

IUPAC[1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine
SMILESCCCOCCC(NN)c1ncc(OC)nc1OC
InChIInChI=1S/C12H22N4O3/c1-4-6-19-7-5-9(16-13)11-12(18-3)15-10(17-2)8-14-11/h8-9,16H,4-7,13H2,1-3H3
InChIKeyCMJJWSBCYYVVOB-UHFFFAOYSA-N
MW270.33 g/mol
LogP0.81
Rot. Bonds9

About [1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine

[1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine (PubChem CID 105332275) has the molecular formula C12H22N4O3 and a molecular weight of 270.33 g/mol. Its IUPAC name is [1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine.

Molecular Properties

Compound Name[1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine
PubChem CID105332275
Molecular FormulaC12H22N4O3
Molecular Weight270.33 g/mol
Exact Mass270.17
IUPAC Name[1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine
SMILESCCCOCCC(NN)c1ncc(OC)nc1OC
InChIInChI=1S/C12H22N4O3/c1-4-6-19-7-5-9(16-13)11-12(18-3)15-10(17-2)8-14-11/h8-9,16H,4-7,13H2,1-3H3
InChIKeyCMJJWSBCYYVVOB-UHFFFAOYSA-N
XLogP0.81
TPSA91.52 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(3-methoxypyrazin-2-yl)-3-propoxypropyl]hydrazine
CID 105332633
1-(3,5-dimethoxypyrazin-2-yl)-N-ethyl-2-propoxyethanamine
CID 107946650
1-(3,5-dimethoxypyrazin-2-yl)-2-propoxyethanamine
CID 107946647
1-(3,5-dimethoxypyrazin-2-yl)-N-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 103216137
3-(2,2-difluoroethoxy)-1-(3,5-dimethoxypyrazin-2-yl)-N-methylpropan-1-amine
CID 103216140
1-(3,5-dimethoxypyrazin-2-yl)-2-methoxy-N-methylethanamine
CID 105178224
1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 103216134
N-[2-cyclobutyl-1-(3,5-dimethoxypyrazin-2-yl)ethyl]propan-1-amine
CID 103169401
1-(3,5-dimethoxypyrazin-2-yl)-4-methoxy-3-methyl-N-propylbutan-1-amine
CID 105178242
1-(3,5-dimethoxypyrazin-2-yl)-N-ethyl-3-methylbutan-1-amine
CID 105030945
3-cyclopentyl-1-(3,5-dimethoxypyrazin-2-yl)-N-ethylpropan-1-amine
CID 105031097
1-(3,5-dimethoxypyrazin-2-yl)-3-methyl-N-propylpentan-1-amine
CID 105031186

Frequently Asked Questions

What is the IUPAC name of [1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine?
The IUPAC name of [1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine (CID 105332275) is [1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine.
What is the SMILES notation for [1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine?
The canonical SMILES for [1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine is CCCOCCC(NN)c1ncc(OC)nc1OC.
What is the InChIKey of [1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine?
The InChIKey is CMJJWSBCYYVVOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O3/c1-4-6-19-7-5-9(16-13)11-12(18-3)15-10(17-2)8-14-11/h8-9,16H,4-7,13H2,1-3H3.
What are the key properties of [1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine?
[1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine has a molecular weight of 270.33 g/mol, XLogP of 0.81, 9 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,5-dimethoxypyrazin-2-yl)-3-propoxypropyl]hydrazine is sourced from PubChem (CID 105332275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).