[2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine

C13H14ClFN2O — CID 103053706

IUPAC[2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine
SMILESCc1occc1C(Cc1cc(Cl)ccc1F)NN
InChIInChI=1S/C13H14ClFN2O/c1-8-11(4-5-18-8)13(17-16)7-9-6-10(14)2-3-12(9)15/h2-6,13,17H,7,16H2,1H3
InChIKeyRAALMLJRKGMCDH-UHFFFAOYSA-N
MW268.72 g/mol
LogP3.13
Rot. Bonds4

About [2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine

[2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine (PubChem CID 103053706) has the molecular formula C13H14ClFN2O and a molecular weight of 268.72 g/mol. Its IUPAC name is [2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine
PubChem CID103053706
Molecular FormulaC13H14ClFN2O
Molecular Weight268.72 g/mol
Exact Mass268.08
IUPAC Name[2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine
SMILESCc1occc1C(Cc1cc(Cl)ccc1F)NN
InChIInChI=1S/C13H14ClFN2O/c1-8-11(4-5-18-8)13(17-16)7-9-6-10(14)2-3-12(9)15/h2-6,13,17H,7,16H2,1H3
InChIKeyRAALMLJRKGMCDH-UHFFFAOYSA-N
XLogP3.13
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.72
LogP ≤ 53.13
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-chloro-2-fluorophenyl)-1-(4-chloro-2-methylphenyl)ethyl]hydrazine
CID 114028450
[2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine
CID 105269073
[2-(5-chloro-2-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethyl]hydrazine
CID 103053835
2-(4-chloro-2-fluorophenyl)-N-ethyl-1-(2-methylfuran-3-yl)ethanamine
CID 114857001
[2-(5-chloro-2-fluorophenyl)-1-(2-methoxyphenyl)ethyl]hydrazine
CID 103053488
1-(2-bromofuran-3-yl)-2-(5-chloro-2-fluorophenyl)-N-methylethanamine
CID 106858959
[2-(5-chloro-2-fluorophenyl)-1-(2-methoxy-5-methylphenyl)ethyl]hydrazine
CID 103053830
[1-(5-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine
CID 105280039
[2-(2,5-dichlorophenyl)-1-(2-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105309794
[1-(5-chloro-2-fluorophenyl)-2-(2,5-dichlorophenyl)ethyl]hydrazine
CID 105280226
[1-(2-methylfuran-3-yl)-2-(3-methylphenyl)ethyl]hydrazine
CID 105269004
[1-(3-bromo-2-chlorophenyl)-2-(5-chloro-2-fluorophenyl)ethyl]hydrazine
CID 103053837

Frequently Asked Questions

What is the IUPAC name of [2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine (CID 103053706) is [2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine is Cc1occc1C(Cc1cc(Cl)ccc1F)NN.
What is the InChIKey of [2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine?
The InChIKey is RAALMLJRKGMCDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClFN2O/c1-8-11(4-5-18-8)13(17-16)7-9-6-10(14)2-3-12(9)15/h2-6,13,17H,7,16H2,1H3.
What are the key properties of [2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine?
[2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine has a molecular weight of 268.72 g/mol, XLogP of 3.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-chloro-2-fluorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine is sourced from PubChem (CID 103053706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).