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

C11H17F3N4O3 — CID 103217739

IUPAC[1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
SMILESCOc1cnc(C(CCOCC(F)(F)F)NN)c(OC)n1
InChIInChI=1S/C11H17F3N4O3/c1-19-8-5-16-9(10(17-8)20-2)7(18-15)3-4-21-6-11(12,13)14/h5,7,18H,3-4,6,15H2,1-2H3
InChIKeyQUZDAVWFHPRADG-UHFFFAOYSA-N
MW310.28 g/mol
LogP0.97
Rot. Bonds8

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

[1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine (PubChem CID 103217739) has the molecular formula C11H17F3N4O3 and a molecular weight of 310.28 g/mol. Its IUPAC name is [1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine.

Molecular Properties

Compound Name[1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
PubChem CID103217739
Molecular FormulaC11H17F3N4O3
Molecular Weight310.28 g/mol
Exact Mass310.13
IUPAC Name[1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
SMILESCOc1cnc(C(CCOCC(F)(F)F)NN)c(OC)n1
InChIInChI=1S/C11H17F3N4O3/c1-19-8-5-16-9(10(17-8)20-2)7(18-15)3-4-21-6-11(12,13)14/h5,7,18H,3-4,6,15H2,1-2H3
InChIKeyQUZDAVWFHPRADG-UHFFFAOYSA-N
XLogP0.97
TPSA91.52 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.28
LogP ≤ 50.97
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'}

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Related Compounds

1-(3-methoxypyrazin-2-yl)-N-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 103148360
N-ethyl-1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 103148577
1-(3-methoxypyrazin-2-yl)-N-propyl-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 103148740
3-(2,2-difluoroethoxy)-1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine
CID 103149316
3-(2,2-difluoroethoxy)-N-ethyl-1-(3-methoxypyrazin-2-yl)propan-1-amine
CID 103149654
3-(2,2-difluoroethoxy)-1-(3-methoxypyrazin-2-yl)-N-propylpropan-1-amine
CID 103149941
[1-(3-Methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151435
[3-(2,2-Difluoroethoxy)-1-(3-methoxypyrazin-2-yl)propyl]hydrazine
CID 103151753
1-(3,5-Dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 103216134
3-(2,2-difluoroethoxy)-1-(3,5-dimethoxypyrazin-2-yl)-N-ethylpropan-1-amine
CID 103216136
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

Frequently Asked Questions

What is the IUPAC name of [1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The IUPAC name of [1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine (CID 103217739) is [1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine.
What is the SMILES notation for [1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The canonical SMILES for [1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine is COc1cnc(C(CCOCC(F)(F)F)NN)c(OC)n1.
What is the InChIKey of [1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The InChIKey is QUZDAVWFHPRADG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F3N4O3/c1-19-8-5-16-9(10(17-8)20-2)7(18-15)3-4-21-6-11(12,13)14/h5,7,18H,3-4,6,15H2,1-2H3.
What are the key properties of [1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
[1-(3,5-dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine has a molecular weight of 310.28 g/mol, XLogP of 0.97, 8 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-(2,2,2-trifluoroethoxy)propyl]hydrazine is sourced from PubChem (CID 103217739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).