[(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine

C15H22ClFN2O — CID 114275469

IUPAC[(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine
SMILESCOC1(C(NN)c2c(F)cccc2Cl)CCCCCC1
InChIInChI=1S/C15H22ClFN2O/c1-20-15(9-4-2-3-5-10-15)14(19-18)13-11(16)7-6-8-12(13)17/h6-8,14,19H,2-5,9-10,18H2,1H3
InChIKeyZKIZGTGRYYFPFP-UHFFFAOYSA-N
MW300.80 g/mol
LogP3.72
Rot. Bonds4

About [(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine

[(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine (PubChem CID 114275469) has the molecular formula C15H22ClFN2O and a molecular weight of 300.80 g/mol. Its IUPAC name is [(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine
PubChem CID114275469
Molecular FormulaC15H22ClFN2O
Molecular Weight300.80 g/mol
Exact Mass300.14
IUPAC Name[(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine
SMILESCOC1(C(NN)c2c(F)cccc2Cl)CCCCCC1
InChIInChI=1S/C15H22ClFN2O/c1-20-15(9-4-2-3-5-10-15)14(19-18)13-11(16)7-6-8-12(13)17/h6-8,14,19H,2-5,9-10,18H2,1H3
InChIKeyZKIZGTGRYYFPFP-UHFFFAOYSA-N
XLogP3.72
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.80
LogP ≤ 53.72
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

N-[(2-chloro-6-fluorophenyl)-(1-methoxycyclobutyl)methyl]ethanamine
CID 114275214
[(2,3-difluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine
CID 105278208
[(2-fluorophenyl)-(1-methoxycyclohexyl)methyl]hydrazine
CID 105275988
1-(2,6-difluorophenyl)-1-(1-methoxycycloheptyl)-N-methylmethanamine
CID 116770190
1-(2,6-difluorophenyl)-1-(1-methoxycyclopentyl)-N-methylmethanamine
CID 104611051
[(2-chloro-5-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine
CID 105397994
[(2,6-difluoro-3-methylphenyl)-(1-methoxycyclobutyl)methyl]hydrazine
CID 105270270
[(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine
CID 105268763
[(2,5-dichlorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine
CID 105268736
[2-(3-chloro-2-fluorophenyl)-1-(1-methoxycycloheptyl)ethyl]hydrazine
CID 102868227
[(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine
CID 114269215
[(1-methoxycycloheptyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105278241

Frequently Asked Questions

What is the IUPAC name of [(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine?
The IUPAC name of [(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine (CID 114275469) is [(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine.
What is the SMILES notation for [(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine?
The canonical SMILES for [(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine is COC1(C(NN)c2c(F)cccc2Cl)CCCCCC1.
What is the InChIKey of [(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine?
The InChIKey is ZKIZGTGRYYFPFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClFN2O/c1-20-15(9-4-2-3-5-10-15)14(19-18)13-11(16)7-6-8-12(13)17/h6-8,14,19H,2-5,9-10,18H2,1H3.
What are the key properties of [(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine?
[(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine has a molecular weight of 300.80 g/mol, XLogP of 3.72, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine is sourced from PubChem (CID 114275469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).