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

C10H15F3N4O2 — CID 103151435

IUPAC[1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
SMILESCOc1nccnc1C(CCOCC(F)(F)F)NN
InChIInChI=1S/C10H15F3N4O2/c1-18-9-8(15-3-4-16-9)7(17-14)2-5-19-6-10(11,12)13/h3-4,7,17H,2,5-6,14H2,1H3
InChIKeySJNVOVPEQKAXML-UHFFFAOYSA-N
MW280.25 g/mol
LogP0.96
Rot. Bonds7

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

[1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine (PubChem CID 103151435) has the molecular formula C10H15F3N4O2 and a molecular weight of 280.25 g/mol. Its IUPAC name is [1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine.

Molecular Properties

Compound Name[1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
PubChem CID103151435
Molecular FormulaC10H15F3N4O2
Molecular Weight280.25 g/mol
Exact Mass280.11
IUPAC Name[1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
SMILESCOc1nccnc1C(CCOCC(F)(F)F)NN
InChIInChI=1S/C10H15F3N4O2/c1-18-9-8(15-3-4-16-9)7(17-14)2-5-19-6-10(11,12)13/h3-4,7,17H,2,5-6,14H2,1H3
InChIKeySJNVOVPEQKAXML-UHFFFAOYSA-N
XLogP0.96
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.25
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-Pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151692
[3-(2,2-Difluoroethoxy)-1-(3-methoxypyrazin-2-yl)propyl]hydrazine
CID 103151753
[3-(2,2-Difluoroethoxy)-1-pyrazin-2-ylpropyl]hydrazine
CID 103152030
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

Frequently Asked Questions

What is the IUPAC name of [1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The IUPAC name of [1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine (CID 103151435) is [1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine.
What is the SMILES notation for [1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The canonical SMILES for [1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine is COc1nccnc1C(CCOCC(F)(F)F)NN.
What is the InChIKey of [1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The InChIKey is SJNVOVPEQKAXML-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F3N4O2/c1-18-9-8(15-3-4-16-9)7(17-14)2-5-19-6-10(11,12)13/h3-4,7,17H,2,5-6,14H2,1H3.
What are the key properties of [1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
[1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine has a molecular weight of 280.25 g/mol, XLogP of 0.96, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine is sourced from PubChem (CID 103151435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).