[2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine

C13H18ClFN2O — CID 105332898

IUPAC[2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine
SMILESCC1CCOC1C(Cc1cccc(F)c1Cl)NN
InChIInChI=1S/C13H18ClFN2O/c1-8-5-6-18-13(8)11(17-16)7-9-3-2-4-10(15)12(9)14/h2-4,8,11,13,17H,5-7,16H2,1H3
InChIKeyXZSXIFMWFDYWGO-UHFFFAOYSA-N
MW272.75 g/mol
LogP2.28
Rot. Bonds4

About [2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine

[2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine (PubChem CID 105332898) has the molecular formula C13H18ClFN2O and a molecular weight of 272.75 g/mol. Its IUPAC name is [2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine
PubChem CID105332898
Molecular FormulaC13H18ClFN2O
Molecular Weight272.75 g/mol
Exact Mass272.11
IUPAC Name[2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine
SMILESCC1CCOC1C(Cc1cccc(F)c1Cl)NN
InChIInChI=1S/C13H18ClFN2O/c1-8-5-6-18-13(8)11(17-16)7-9-3-2-4-10(15)12(9)14/h2-4,8,11,13,17H,5-7,16H2,1H3
InChIKeyXZSXIFMWFDYWGO-UHFFFAOYSA-N
XLogP2.28
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 ≤ 52.28
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-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine
CID 105234339
2-(2-chloro-3-fluorophenyl)-N-methyl-1-(oxan-4-yl)ethanamine
CID 112653790
[1-(2-chloro-3-fluorophenyl)-3-cyclobutylpropan-2-yl]hydrazine
CID 103170767
[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine
CID 105316051
(2,6-difluorophenyl)-(3-methyloxolan-2-yl)methanamine
CID 115859971
2-(2-chloro-3-fluorophenyl)-1-cyclobutyl-N-methylethanamine
CID 112653742
[3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine
CID 105272648
2-(2-chloro-3-fluorophenyl)-1-(2-methylcyclopropyl)ethanol
CID 112653482
[2-(3-chloro-2-fluorophenyl)-1-(oxan-4-yl)ethyl]hydrazine
CID 105264342
1-(2-chloro-6-fluorophenyl)-N-methyl-1-(3-methyloxolan-2-yl)methanamine
CID 114275397
[2-(2-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
CID 105332792
[2-(2-chloro-3-fluorophenyl)-1-(1-methoxy-4-methylcyclohexyl)ethyl]hydrazine
CID 105277013

Frequently Asked Questions

What is the IUPAC name of [2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine (CID 105332898) is [2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine is CC1CCOC1C(Cc1cccc(F)c1Cl)NN.
What is the InChIKey of [2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine?
The InChIKey is XZSXIFMWFDYWGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClFN2O/c1-8-5-6-18-13(8)11(17-16)7-9-3-2-4-10(15)12(9)14/h2-4,8,11,13,17H,5-7,16H2,1H3.
What are the key properties of [2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine?
[2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine has a molecular weight of 272.75 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105332898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).