[2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine

C13H19F3N2O2 — CID 105271821

IUPAC[2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine
SMILESCCCC(OC)C(NN)c1ccccc1OC(F)(F)F
InChIInChI=1S/C13H19F3N2O2/c1-3-6-11(19-2)12(18-17)9-7-4-5-8-10(9)20-13(14,15)16/h4-5,7-8,11-12,18H,3,6,17H2,1-2H3
InChIKeyWOFAYTFYNZOSMN-UHFFFAOYSA-N
MW292.30 g/mol
LogP2.90
Rot. Bonds7

About [2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine

[2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine (PubChem CID 105271821) has the molecular formula C13H19F3N2O2 and a molecular weight of 292.30 g/mol. Its IUPAC name is [2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine.

Molecular Properties

Compound Name[2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine
PubChem CID105271821
Molecular FormulaC13H19F3N2O2
Molecular Weight292.30 g/mol
Exact Mass292.14
IUPAC Name[2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine
SMILESCCCC(OC)C(NN)c1ccccc1OC(F)(F)F
InChIInChI=1S/C13H19F3N2O2/c1-3-6-11(19-2)12(18-17)9-7-4-5-8-10(9)20-13(14,15)16/h4-5,7-8,11-12,18H,3,6,17H2,1-2H3
InChIKeyWOFAYTFYNZOSMN-UHFFFAOYSA-N
XLogP2.90
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.30
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-methoxy-N-methyl-1-[2-(trifluoromethoxy)phenyl]butan-1-amine
CID 116715413
[2-methyl-3-methylsulfanyl-1-[2-(trifluoromethoxy)phenyl]propyl]hydrazine
CID 114222154
N-ethyl-2-methyl-1-[2-(trifluoromethoxy)phenyl]pentan-1-amine
CID 115850903
[1-(5-chloro-2-methoxyphenyl)-2-methoxypentyl]hydrazine
CID 105271901
[2-ethoxy-1-[2-(2-methoxyethoxy)phenyl]pentyl]hydrazine
CID 105271536
ethyl 2-[2-(trifluoromethoxy)phenyl]pentanoate
CID 83043039
[2-ethoxy-1-[2-(trifluoromethoxy)phenyl]ethyl]hydrazine
CID 105235372
2-methoxy-1-(2-methoxyphenyl)pentan-1-amine
CID 116718510
2,2-dimethoxy-N-methyl-1-[2-(trifluoromethoxy)phenyl]ethanamine
CID 79492226
N-ethyl-2-methoxy-3-methyl-1-[2-(trifluoromethoxy)phenyl]butan-1-amine
CID 116720263
[2-ethoxy-1-(5-fluoro-2-methoxyphenyl)pentyl]hydrazine
CID 105271459
[1-(3,4-dimethoxyphenyl)-2-methoxypentyl]hydrazine
CID 105271639

Frequently Asked Questions

What is the IUPAC name of [2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine?
The IUPAC name of [2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine (CID 105271821) is [2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine.
What is the SMILES notation for [2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine?
The canonical SMILES for [2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine is CCCC(OC)C(NN)c1ccccc1OC(F)(F)F.
What is the InChIKey of [2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine?
The InChIKey is WOFAYTFYNZOSMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19F3N2O2/c1-3-6-11(19-2)12(18-17)9-7-4-5-8-10(9)20-13(14,15)16/h4-5,7-8,11-12,18H,3,6,17H2,1-2H3.
What are the key properties of [2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine?
[2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine has a molecular weight of 292.30 g/mol, XLogP of 2.90, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxy-1-[2-(trifluoromethoxy)phenyl]pentyl]hydrazine is sourced from PubChem (CID 105271821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).