[(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine

C12H16ClFN2O — CID 105397915

IUPAC[(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine
SMILESCC1(C(NN)c2cc(F)ccc2Cl)CCCO1
InChIInChI=1S/C12H16ClFN2O/c1-12(5-2-6-17-12)11(16-15)9-7-8(14)3-4-10(9)13/h3-4,7,11,16H,2,5-6,15H2,1H3
InChIKeyRFYMYYKYJLFDJD-UHFFFAOYSA-N
MW258.72 g/mol
LogP2.55
Rot. Bonds3

About [(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine

[(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine (PubChem CID 105397915) has the molecular formula C12H16ClFN2O and a molecular weight of 258.72 g/mol. Its IUPAC name is [(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine
PubChem CID105397915
Molecular FormulaC12H16ClFN2O
Molecular Weight258.72 g/mol
Exact Mass258.09
IUPAC Name[(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine
SMILESCC1(C(NN)c2cc(F)ccc2Cl)CCCO1
InChIInChI=1S/C12H16ClFN2O/c1-12(5-2-6-17-12)11(16-15)9-7-8(14)3-4-10(9)13/h3-4,7,11,16H,2,5-6,15H2,1H3
InChIKeyRFYMYYKYJLFDJD-UHFFFAOYSA-N
XLogP2.55
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.72
LogP ≤ 52.55
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-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]propan-1-amine
CID 105395284
[(2-chloro-5-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine
CID 105397994
[(2-methyloxolan-2-yl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105250675
[(5-fluoro-1-benzofuran-2-yl)-(2-methyloxan-2-yl)methyl]hydrazine
CID 105256316
2-(2-chloro-5-fluorophenyl)-N-methyl-1-(2-methyloxolan-2-yl)ethanamine
CID 102619155
[(2-chloro-5-fluorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine
CID 105397987
[(2-methyloxolan-2-yl)-(4-methylphenyl)methyl]hydrazine
CID 105250712
[(3,4-dimethylphenyl)-(2-methyloxolan-2-yl)methyl]hydrazine
CID 105250890
[(2,5-dichlorophenyl)-(1-methylcyclopropyl)methyl]hydrazine
CID 105253423
[(2,4-difluorophenyl)-(1-methylcyclohexyl)methyl]hydrazine
CID 106831197
[(2-chloro-5-fluorophenyl)-(2,2-dimethylcyclohexyl)methyl]hydrazine
CID 107194986
[(2,4-dimethoxyphenyl)-(2-methyloxan-2-yl)methyl]hydrazine
CID 105256300

Frequently Asked Questions

What is the IUPAC name of [(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine?
The IUPAC name of [(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine (CID 105397915) is [(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine.
What is the SMILES notation for [(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine?
The canonical SMILES for [(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine is CC1(C(NN)c2cc(F)ccc2Cl)CCCO1.
What is the InChIKey of [(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine?
The InChIKey is RFYMYYKYJLFDJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClFN2O/c1-12(5-2-6-17-12)11(16-15)9-7-8(14)3-4-10(9)13/h3-4,7,11,16H,2,5-6,15H2,1H3.
What are the key properties of [(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine?
[(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine has a molecular weight of 258.72 g/mol, XLogP of 2.55, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-chloro-5-fluorophenyl)-(2-methyloxolan-2-yl)methyl]hydrazine is sourced from PubChem (CID 105397915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).