[1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine

C13H19ClN2O2 — CID 105266240

IUPAC[1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine
SMILESCOc1ccc(Cl)cc1C(CC1CCOC1)NN
InChIInChI=1S/C13H19ClN2O2/c1-17-13-3-2-10(14)7-11(13)12(16-15)6-9-4-5-18-8-9/h2-3,7,9,12,16H,4-6,8,15H2,1H3
InChIKeyVQPXAJVEPUWCNW-UHFFFAOYSA-N
MW270.76 g/mol
LogP2.28
Rot. Bonds5

About [1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine

[1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine (PubChem CID 105266240) has the molecular formula C13H19ClN2O2 and a molecular weight of 270.76 g/mol. Its IUPAC name is [1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine
PubChem CID105266240
Molecular FormulaC13H19ClN2O2
Molecular Weight270.76 g/mol
Exact Mass270.11
IUPAC Name[1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine
SMILESCOc1ccc(Cl)cc1C(CC1CCOC1)NN
InChIInChI=1S/C13H19ClN2O2/c1-17-13-3-2-10(14)7-11(13)12(16-15)6-9-4-5-18-8-9/h2-3,7,9,12,16H,4-6,8,15H2,1H3
InChIKeyVQPXAJVEPUWCNW-UHFFFAOYSA-N
XLogP2.28
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[1-(2-methoxy-5-methylphenyl)-2-(oxan-4-yl)ethyl]hydrazine
CID 105298761
[1-(2,5-dimethoxyphenyl)-2-(oxan-4-yl)ethyl]hydrazine
CID 105298736
[1-(5-chloro-2-methoxyphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267580
1-(5-fluoro-2-methoxyphenyl)-N-methyl-2-(oxolan-3-yl)ethanamine
CID 103987025
1-(2,5-dimethoxyphenyl)-N-ethyl-2-(oxolan-3-yl)ethanamine
CID 103987375
[1-(2-bromo-4-chlorophenyl)-2-(oxan-4-yl)ethyl]hydrazine
CID 107996948
[1-(5-chloro-2-methoxyphenyl)-4-methylpentyl]hydrazine
CID 105207718
(1S)-1-(5-chloro-2-methoxyphenyl)-2-cyclopropylethanamine;hydrochloride
CID 171234667
(S)-(5-chloro-2-methoxyphenyl)-(oxan-4-yl)methanamine
CID 171244638
[2-cyclohexyl-1-(5-fluoro-2-methoxyphenyl)ethyl]hydrazine
CID 105330836
[1-(3-bromo-4-methoxyphenyl)-2-(oxan-4-yl)ethyl]hydrazine
CID 105298912
[1-(5-chloro-2-methoxyphenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine
CID 105200255

Frequently Asked Questions

What is the IUPAC name of [1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine?
The IUPAC name of [1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine (CID 105266240) is [1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine is COc1ccc(Cl)cc1C(CC1CCOC1)NN.
What is the InChIKey of [1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine?
The InChIKey is VQPXAJVEPUWCNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2O2/c1-17-13-3-2-10(14)7-11(13)12(16-15)6-9-4-5-18-8-9/h2-3,7,9,12,16H,4-6,8,15H2,1H3.
What are the key properties of [1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine?
[1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine has a molecular weight of 270.76 g/mol, XLogP of 2.28, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-chloro-2-methoxyphenyl)-2-(oxolan-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105266240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).