[1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine

C16H14BrClN2O — CID 105218403

IUPAC[1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Br)cc1Cl)c1cc2ccccc2o1
InChIInChI=1S/C16H14BrClN2O/c17-12-6-5-10(13(18)9-12)7-14(20-19)16-8-11-3-1-2-4-15(11)21-16/h1-6,8-9,14,20H,7,19H2
InChIKeyBILXMMBROSLMQX-UHFFFAOYSA-N
MW365.66 g/mol
LogP4.60
Rot. Bonds4

About [1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine

[1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine (PubChem CID 105218403) has the molecular formula C16H14BrClN2O and a molecular weight of 365.66 g/mol. Its IUPAC name is [1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine
PubChem CID105218403
Molecular FormulaC16H14BrClN2O
Molecular Weight365.66 g/mol
Exact Mass364.00
IUPAC Name[1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Br)cc1Cl)c1cc2ccccc2o1
InChIInChI=1S/C16H14BrClN2O/c17-12-6-5-10(13(18)9-12)7-14(20-19)16-8-11-3-1-2-4-15(11)21-16/h1-6,8-9,14,20H,7,19H2
InChIKeyBILXMMBROSLMQX-UHFFFAOYSA-N
XLogP4.60
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.66
LogP ≤ 54.60
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-(4-bromo-2-chlorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine
CID 105335235
[1-(1-benzofuran-2-yl)-2-phenylethyl]hydrazine
CID 105195415
[1-(3-bromo-2-chlorophenyl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine
CID 105335248
[2-(4-bromo-2-chlorophenyl)-1-(3-chloro-2-fluorophenyl)ethyl]hydrazine
CID 105223390
[2-(4-bromo-2-chlorophenyl)-1-(2-ethylfuran-3-yl)ethyl]hydrazine
CID 114104865
1-benzofuran-2-yl-(5-bromo-2-chlorophenyl)methanamine
CID 105043963
[2-(4-bromo-2-chlorophenyl)-1-thiophen-3-ylethyl]hydrazine
CID 105196835
N-[1-benzofuran-2-yl-(4-bromo-2-chlorophenyl)methyl]ethanamine
CID 105043926
[2-(4-bromo-2-chlorophenyl)-1-(2-bromo-4-fluorophenyl)ethyl]hydrazine
CID 105335194
[2-(4-bromo-2-chlorophenyl)-1-(5-chloro-2-iodophenyl)ethyl]hydrazine
CID 114030639
[2-(4-bromo-2-chlorophenyl)-1-(2-chloro-4-pyridinyl)ethyl]hydrazine
CID 105252774
1-(7-bromo-1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethanol
CID 105126626

Frequently Asked Questions

What is the IUPAC name of [1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine?
The IUPAC name of [1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine (CID 105218403) is [1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine?
The canonical SMILES for [1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine is NNC(Cc1ccc(Br)cc1Cl)c1cc2ccccc2o1.
What is the InChIKey of [1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine?
The InChIKey is BILXMMBROSLMQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14BrClN2O/c17-12-6-5-10(13(18)9-12)7-14(20-19)16-8-11-3-1-2-4-15(11)21-16/h1-6,8-9,14,20H,7,19H2.
What are the key properties of [1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine?
[1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine has a molecular weight of 365.66 g/mol, XLogP of 4.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-benzofuran-2-yl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105218403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).