[1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine

C7H11BrN2O2 — CID 105207395

IUPAC[1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine
SMILESCOCC(NN)c1occc1Br
InChIInChI=1S/C7H11BrN2O2/c1-11-4-6(10-9)7-5(8)2-3-12-7/h2-3,6,10H,4,9H2,1H3
InChIKeyOBKXDGRWVDAMMU-UHFFFAOYSA-N
MW235.08 g/mol
LogP1.19
Rot. Bonds4

About [1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine

[1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine (PubChem CID 105207395) has the molecular formula C7H11BrN2O2 and a molecular weight of 235.08 g/mol. Its IUPAC name is [1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine
PubChem CID105207395
Molecular FormulaC7H11BrN2O2
Molecular Weight235.08 g/mol
Exact Mass234.00
IUPAC Name[1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine
SMILESCOCC(NN)c1occc1Br
InChIInChI=1S/C7H11BrN2O2/c1-11-4-6(10-9)7-5(8)2-3-12-7/h2-3,6,10H,4,9H2,1H3
InChIKeyOBKXDGRWVDAMMU-UHFFFAOYSA-N
XLogP1.19
TPSA60.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.08
LogP ≤ 51.19
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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Frequently Asked Questions

What is the IUPAC name of [1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine?
The IUPAC name of [1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine (CID 105207395) is [1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine.
What is the SMILES notation for [1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine?
The canonical SMILES for [1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine is COCC(NN)c1occc1Br.
What is the InChIKey of [1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine?
The InChIKey is OBKXDGRWVDAMMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11BrN2O2/c1-11-4-6(10-9)7-5(8)2-3-12-7/h2-3,6,10H,4,9H2,1H3.
What are the key properties of [1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine?
[1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine has a molecular weight of 235.08 g/mol, XLogP of 1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromofuran-2-yl)-2-methoxyethyl]hydrazine is sourced from PubChem (CID 105207395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).