[2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine

C17H26BrFN2 — CID 105327110

IUPAC[2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine
SMILESCC(C)CC1(C(Cc2cccc(F)c2Br)NN)CCCC1
InChIInChI=1S/C17H26BrFN2/c1-12(2)11-17(8-3-4-9-17)15(21-20)10-13-6-5-7-14(19)16(13)18/h5-7,12,15,21H,3-4,8-11,20H2,1-2H3
InChIKeyNXSBKAWFSBNIJI-UHFFFAOYSA-N
MW357.31 g/mol
LogP4.57
Rot. Bonds6

About [2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine

[2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine (PubChem CID 105327110) has the molecular formula C17H26BrFN2 and a molecular weight of 357.31 g/mol. Its IUPAC name is [2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine
PubChem CID105327110
Molecular FormulaC17H26BrFN2
Molecular Weight357.31 g/mol
Exact Mass356.13
IUPAC Name[2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine
SMILESCC(C)CC1(C(Cc2cccc(F)c2Br)NN)CCCC1
InChIInChI=1S/C17H26BrFN2/c1-12(2)11-17(8-3-4-9-17)15(21-20)10-13-6-5-7-14(19)16(13)18/h5-7,12,15,21H,3-4,8-11,20H2,1-2H3
InChIKeyNXSBKAWFSBNIJI-UHFFFAOYSA-N
XLogP4.57
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.31
LogP ≤ 54.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-(5-bromo-2-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine
CID 105294936
[2-(2,4-difluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine
CID 105291852
[2-(4-fluoro-2-methylphenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine
CID 105340855
[2-(4-bromo-2-chlorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine
CID 105335222
1-[2-(2-bromo-3-fluorophenyl)-1-hydroxyethyl]cycloheptan-1-ol
CID 103452055
[2-(3-bromo-5-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine
CID 105324822
2-(2-bromo-3-fluorophenyl)-1-(1-methoxycyclohexyl)-N-methylethanamine
CID 116762886
[2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine
CID 105255038
2-(2-chloro-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethanol
CID 115831198
[2-(furan-3-yl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine
CID 105331813
[1-(2-bromo-3-fluorophenyl)-3-(2,6-difluorophenyl)propan-2-yl]hydrazine
CID 105327024
[2-(2-fluorophenyl)-1-(1-methoxycyclohexyl)ethyl]hydrazine
CID 105276009

Frequently Asked Questions

What is the IUPAC name of [2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine?
The IUPAC name of [2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine (CID 105327110) is [2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine.
What is the SMILES notation for [2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine?
The canonical SMILES for [2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine is CC(C)CC1(C(Cc2cccc(F)c2Br)NN)CCCC1.
What is the InChIKey of [2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine?
The InChIKey is NXSBKAWFSBNIJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26BrFN2/c1-12(2)11-17(8-3-4-9-17)15(21-20)10-13-6-5-7-14(19)16(13)18/h5-7,12,15,21H,3-4,8-11,20H2,1-2H3.
What are the key properties of [2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine?
[2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine has a molecular weight of 357.31 g/mol, XLogP of 4.57, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromo-3-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine is sourced from PubChem (CID 105327110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).