[(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine

C13H18ClFN2O — CID 105268763

IUPAC[(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine
SMILESCOC1(C(NN)c2ccc(Cl)cc2F)CCCC1
InChIInChI=1S/C13H18ClFN2O/c1-18-13(6-2-3-7-13)12(17-16)10-5-4-9(14)8-11(10)15/h4-5,8,12,17H,2-3,6-7,16H2,1H3
InChIKeyJNWGDEHVBIPPPQ-UHFFFAOYSA-N
MW272.75 g/mol
LogP2.94
Rot. Bonds4

About [(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine

[(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine (PubChem CID 105268763) has the molecular formula C13H18ClFN2O and a molecular weight of 272.75 g/mol. Its IUPAC name is [(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine
PubChem CID105268763
Molecular FormulaC13H18ClFN2O
Molecular Weight272.75 g/mol
Exact Mass272.11
IUPAC Name[(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine
SMILESCOC1(C(NN)c2ccc(Cl)cc2F)CCCC1
InChIInChI=1S/C13H18ClFN2O/c1-18-13(6-2-3-7-13)12(17-16)10-5-4-9(14)8-11(10)15/h4-5,8,12,17H,2-3,6-7,16H2,1H3
InChIKeyJNWGDEHVBIPPPQ-UHFFFAOYSA-N
XLogP2.94
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.75
LogP ≤ 52.94
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

[(2,5-dichlorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine
CID 105268736
[(4-chloro-2-fluorophenyl)-(1-ethoxycyclohexyl)methyl]hydrazine
CID 105276350
[(2-fluoro-4-methoxyphenyl)-(1-methoxycyclobutyl)methyl]hydrazine
CID 103397668
[(2-fluorophenyl)-(1-methoxycyclohexyl)methyl]hydrazine
CID 105275988
[(2-chloro-5-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine
CID 105397994
[(2,3-difluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine
CID 105278208
[(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine
CID 114275469
[(5-fluoro-2-methylphenyl)-(1-methoxycyclohexyl)methyl]hydrazine
CID 105275942
[(5-fluoro-2-methoxyphenyl)-(1-methoxycyclohexyl)methyl]hydrazine
CID 105276084
[(2-fluoro-4-methoxyphenyl)-(1-methoxy-3-methylcyclohexyl)methyl]hydrazine
CID 103397686
[(1-ethoxycyclohexyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine
CID 103397682
[(4-methoxyoxan-4-yl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105276457

Frequently Asked Questions

What is the IUPAC name of [(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine?
The IUPAC name of [(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine (CID 105268763) is [(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine.
What is the SMILES notation for [(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine?
The canonical SMILES for [(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine is COC1(C(NN)c2ccc(Cl)cc2F)CCCC1.
What is the InChIKey of [(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine?
The InChIKey is JNWGDEHVBIPPPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClFN2O/c1-18-13(6-2-3-7-13)12(17-16)10-5-4-9(14)8-11(10)15/h4-5,8,12,17H,2-3,6-7,16H2,1H3.
What are the key properties of [(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine?
[(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine has a molecular weight of 272.75 g/mol, XLogP of 2.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine is sourced from PubChem (CID 105268763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).