[2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine

C12H13BrN2O — CID 105215016

IUPAC[2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine
SMILESNNC(Cc1ccccc1Br)c1ccoc1
InChIInChI=1S/C12H13BrN2O/c13-11-4-2-1-3-9(11)7-12(15-14)10-5-6-16-8-10/h1-6,8,12,15H,7,14H2
InChIKeyHAASHZBYCVUTRE-UHFFFAOYSA-N
MW281.15 g/mol
LogP2.79
Rot. Bonds4

About [2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine

[2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine (PubChem CID 105215016) has the molecular formula C12H13BrN2O and a molecular weight of 281.15 g/mol. Its IUPAC name is [2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine
PubChem CID105215016
Molecular FormulaC12H13BrN2O
Molecular Weight281.15 g/mol
Exact Mass280.02
IUPAC Name[2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine
SMILESNNC(Cc1ccccc1Br)c1ccoc1
InChIInChI=1S/C12H13BrN2O/c13-11-4-2-1-3-9(11)7-12(15-14)10-5-6-16-8-10/h1-6,8,12,15H,7,14H2
InChIKeyHAASHZBYCVUTRE-UHFFFAOYSA-N
XLogP2.79
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.15
LogP ≤ 52.79
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-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine (CID 105215016) is [2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine is NNC(Cc1ccccc1Br)c1ccoc1.
What is the InChIKey of [2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine?
The InChIKey is HAASHZBYCVUTRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13BrN2O/c13-11-4-2-1-3-9(11)7-12(15-14)10-5-6-16-8-10/h1-6,8,12,15H,7,14H2.
What are the key properties of [2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine?
[2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine has a molecular weight of 281.15 g/mol, XLogP of 2.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromophenyl)-1-(furan-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105215016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).