[2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine

C13H15ClN2O — CID 105269073

IUPAC[2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine
SMILESCc1occc1C(Cc1ccccc1Cl)NN
InChIInChI=1S/C13H15ClN2O/c1-9-11(6-7-17-9)13(16-15)8-10-4-2-3-5-12(10)14/h2-7,13,16H,8,15H2,1H3
InChIKeyMDJUAUZRHUCITQ-UHFFFAOYSA-N
MW250.73 g/mol
LogP2.99
Rot. Bonds4

About [2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine

[2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine (PubChem CID 105269073) has the molecular formula C13H15ClN2O and a molecular weight of 250.73 g/mol. Its IUPAC name is [2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine
PubChem CID105269073
Molecular FormulaC13H15ClN2O
Molecular Weight250.73 g/mol
Exact Mass250.09
IUPAC Name[2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine
SMILESCc1occc1C(Cc1ccccc1Cl)NN
InChIInChI=1S/C13H15ClN2O/c1-9-11(6-7-17-9)13(16-15)8-10-4-2-3-5-12(10)14/h2-7,13,16H,8,15H2,1H3
InChIKeyMDJUAUZRHUCITQ-UHFFFAOYSA-N
XLogP2.99
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.73
LogP ≤ 52.99
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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Frequently Asked Questions

What is the IUPAC name of [2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine (CID 105269073) is [2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine is Cc1occc1C(Cc1ccccc1Cl)NN.
What is the InChIKey of [2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine?
The InChIKey is MDJUAUZRHUCITQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2O/c1-9-11(6-7-17-9)13(16-15)8-10-4-2-3-5-12(10)14/h2-7,13,16H,8,15H2,1H3.
What are the key properties of [2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine?
[2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine has a molecular weight of 250.73 g/mol, XLogP of 2.99, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chlorophenyl)-1-(2-methylfuran-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105269073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).