[2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine

C15H23F3N2O — CID 105305170

IUPAC[2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine
SMILESCCCC(CCC)C(NN)c1cccc(OC(F)(F)F)c1
InChIInChI=1S/C15H23F3N2O/c1-3-6-11(7-4-2)14(20-19)12-8-5-9-13(10-12)21-15(16,17)18/h5,8-11,14,20H,3-4,6-7,19H2,1-2H3
InChIKeyVQPMAPCJYYVDCM-UHFFFAOYSA-N
MW304.36 g/mol
LogP4.31
Rot. Bonds8

About [2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine

[2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine (PubChem CID 105305170) has the molecular formula C15H23F3N2O and a molecular weight of 304.36 g/mol. Its IUPAC name is [2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine.

Molecular Properties

Compound Name[2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine
PubChem CID105305170
Molecular FormulaC15H23F3N2O
Molecular Weight304.36 g/mol
Exact Mass304.18
IUPAC Name[2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine
SMILESCCCC(CCC)C(NN)c1cccc(OC(F)(F)F)c1
InChIInChI=1S/C15H23F3N2O/c1-3-6-11(7-4-2)14(20-19)12-8-5-9-13(10-12)21-15(16,17)18/h5,8-11,14,20H,3-4,6-7,19H2,1-2H3
InChIKeyVQPMAPCJYYVDCM-UHFFFAOYSA-N
XLogP4.31
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.36
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

[4-methyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine
CID 105207651
[2-methoxy-2-methyl-1-[3-(trifluoromethoxy)phenyl]butyl]hydrazine
CID 105274524
N-[2,2-difluoro-1-[3-(trifluoromethoxy)phenyl]ethyl]propan-1-amine
CID 103516612
(1S)-1-[3-(trifluoromethoxy)phenyl]pentan-1-amine;hydrochloride
CID 171229785
(1S,2R)-1-amino-1-[3-(trifluoromethoxy)phenyl]pentan-2-ol;hydrochloride
CID 171161781
[1-[4-fluoro-3-(trifluoromethyl)phenyl]-2-propylpentyl]hydrazine
CID 107292585
1-[3-(trifluoromethoxy)phenyl]nonan-1-amine
CID 115854116
1-hexan-2-yl-3-(trifluoromethoxy)benzene
CID 123947966
N-ethyl-1-[3-(trifluoromethoxy)phenyl]hexan-1-amine
CID 115854010
3-methyl-1-[3-(trifluoromethoxy)phenyl]hexan-1-ol
CID 107105020
(1S)-2-methyl-1-[3-(trifluoromethoxy)phenyl]butan-1-amine
CID 171229811
2-(2,2-dimethylhydrazinyl)-2-[3-(trifluoromethoxy)phenyl]ethanamine
CID 107104668

Frequently Asked Questions

What is the IUPAC name of [2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine?
The IUPAC name of [2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine (CID 105305170) is [2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine.
What is the SMILES notation for [2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine?
The canonical SMILES for [2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine is CCCC(CCC)C(NN)c1cccc(OC(F)(F)F)c1.
What is the InChIKey of [2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine?
The InChIKey is VQPMAPCJYYVDCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23F3N2O/c1-3-6-11(7-4-2)14(20-19)12-8-5-9-13(10-12)21-15(16,17)18/h5,8-11,14,20H,3-4,6-7,19H2,1-2H3.
What are the key properties of [2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine?
[2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine has a molecular weight of 304.36 g/mol, XLogP of 4.31, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-propyl-1-[3-(trifluoromethoxy)phenyl]pentyl]hydrazine is sourced from PubChem (CID 105305170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).