[(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine

C13H18BrFN2 — CID 105323101

IUPAC[(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine
SMILESCC1(C(NN)c2cc(Br)ccc2F)CCCC1
InChIInChI=1S/C13H18BrFN2/c1-13(6-2-3-7-13)12(17-16)10-8-9(14)4-5-11(10)15/h4-5,8,12,17H,2-3,6-7,16H2,1H3
InChIKeySXLFKGJSUYWIBK-UHFFFAOYSA-N
MW301.20 g/mol
LogP3.67
Rot. Bonds3

About [(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine

[(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine (PubChem CID 105323101) has the molecular formula C13H18BrFN2 and a molecular weight of 301.20 g/mol. Its IUPAC name is [(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine
PubChem CID105323101
Molecular FormulaC13H18BrFN2
Molecular Weight301.20 g/mol
Exact Mass300.06
IUPAC Name[(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine
SMILESCC1(C(NN)c2cc(Br)ccc2F)CCCC1
InChIInChI=1S/C13H18BrFN2/c1-13(6-2-3-7-13)12(17-16)10-8-9(14)4-5-11(10)15/h4-5,8,12,17H,2-3,6-7,16H2,1H3
InChIKeySXLFKGJSUYWIBK-UHFFFAOYSA-N
XLogP3.67
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.20
LogP ≤ 53.67
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'}

Analyze [(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(5-bromo-2-fluorophenyl)-(1-methylcyclopropyl)methyl]hydrazine
CID 105253463
[(5-bromo-2-fluorophenyl)-(2-methylthiolan-2-yl)methyl]hydrazine
CID 105323190
[(2,4-difluorophenyl)-(1-methylcyclohexyl)methyl]hydrazine
CID 106831197
[(3-bromo-2,6-difluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine
CID 106945625
1-[1-(aminomethyl)cyclobutyl]-1-(5-bromo-2-fluorophenyl)-N-methylmethanamine
CID 116958816
N-[(5-bromo-2-fluorophenyl)-(1-ethylcyclopentyl)methyl]ethanamine
CID 105011844
1-(2-fluoro-5-methylphenyl)-N-methyl-1-(1-methylcyclohexyl)methanamine
CID 106830046
[(4-chlorophenyl)-(1-methylcyclopentyl)methyl]hydrazine
CID 105281123
[2-(5-bromo-2-fluorophenyl)-1-(1-methylcyclopropyl)ethyl]hydrazine
CID 105253385
(2,5-dibromophenyl)-(1-methylcyclohexyl)methanamine
CID 106826771
[(2,5-dichlorophenyl)-(1-methylcyclopropyl)methyl]hydrazine
CID 105253423
N-[(5-bromo-2-fluorophenyl)-(2-methylthiolan-2-yl)methyl]propan-1-amine
CID 105167473

Frequently Asked Questions

What is the IUPAC name of [(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine?
The IUPAC name of [(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine (CID 105323101) is [(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine.
What is the SMILES notation for [(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine?
The canonical SMILES for [(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine is CC1(C(NN)c2cc(Br)ccc2F)CCCC1.
What is the InChIKey of [(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine?
The InChIKey is SXLFKGJSUYWIBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18BrFN2/c1-13(6-2-3-7-13)12(17-16)10-8-9(14)4-5-11(10)15/h4-5,8,12,17H,2-3,6-7,16H2,1H3.
What are the key properties of [(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine?
[(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine has a molecular weight of 301.20 g/mol, XLogP of 3.67, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-bromo-2-fluorophenyl)-(1-methylcyclopentyl)methyl]hydrazine is sourced from PubChem (CID 105323101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).