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

C9H13F3N4O — CID 103151692

IUPAC[1-pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
SMILESNNC(CCOCC(F)(F)F)c1cnccn1
InChIInChI=1S/C9H13F3N4O/c10-9(11,12)6-17-4-1-7(16-13)8-5-14-2-3-15-8/h2-3,5,7,16H,1,4,6,13H2
InChIKeyIQULTTLPVNXBQL-UHFFFAOYSA-N
MW250.22 g/mol
LogP0.95
Rot. Bonds6

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

[1-pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine (PubChem CID 103151692) has the molecular formula C9H13F3N4O and a molecular weight of 250.22 g/mol. Its IUPAC name is [1-pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine.

Molecular Properties

Compound Name[1-pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
PubChem CID103151692
Molecular FormulaC9H13F3N4O
Molecular Weight250.22 g/mol
Exact Mass250.10
IUPAC Name[1-pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
SMILESNNC(CCOCC(F)(F)F)c1cnccn1
InChIInChI=1S/C9H13F3N4O/c10-9(11,12)6-17-4-1-7(16-13)8-5-14-2-3-15-8/h2-3,5,7,16H,1,4,6,13H2
InChIKeyIQULTTLPVNXBQL-UHFFFAOYSA-N
XLogP0.95
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.22
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

N-ethyl-1-pyrazin-2-yl-4-(2,2,2-trifluoroethoxy)butan-1-amine
CID 55095074
2-[5-(Trifluoromethyl)pyrazolidin-3-yl]pyrazine
CID 73711550
3-Amino-3-[5-(difluoromethyl)pyrazin-2-yl]propan-1-ol
CID 84671275
3-Amino-3-[6-(difluoromethyl)pyrazin-2-yl]propan-1-ol
CID 84671279
3-(2,2-Difluoroethoxy)-1-pyrazin-2-ylpropan-1-amine
CID 103149020
3-(2,2-difluoroethoxy)-N-methyl-1-pyrazin-2-ylpropan-1-amine
CID 103149349
3-(2,2-difluoroethoxy)-N-propyl-1-pyrazin-2-ylpropan-1-amine
CID 103149968
[1-(3-Methoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151435
[3-(2,2-Difluoroethoxy)-1-pyrazin-2-ylpropyl]hydrazine
CID 103152030
[1-Pyrazin-2-yl-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
CID 103217505
[1-Pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethyl]hydrazine
CID 103477583
(4,4,4-Trifluoro-1-pyrazin-2-ylbutyl)hydrazine
CID 105203227

Frequently Asked Questions

What is the IUPAC name of [1-pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The IUPAC name of [1-pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine (CID 103151692) is [1-pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine.
What is the SMILES notation for [1-pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The canonical SMILES for [1-pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine is NNC(CCOCC(F)(F)F)c1cnccn1.
What is the InChIKey of [1-pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The InChIKey is IQULTTLPVNXBQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13F3N4O/c10-9(11,12)6-17-4-1-7(16-13)8-5-14-2-3-15-8/h2-3,5,7,16H,1,4,6,13H2.
What are the key properties of [1-pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
[1-pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine has a molecular weight of 250.22 g/mol, XLogP of 0.95, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-pyrazin-2-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine is sourced from PubChem (CID 103151692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).