[(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine

C9H9BrN2OS — CID 105213683

IUPAC[(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine
SMILESNNC(c1ccco1)c1sccc1Br
InChIInChI=1S/C9H9BrN2OS/c10-6-3-5-14-9(6)8(12-11)7-2-1-4-13-7/h1-5,8,12H,11H2
InChIKeyAVUKWFJQDPNDNS-UHFFFAOYSA-N
MW273.16 g/mol
LogP2.66
Rot. Bonds3

About [(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine

[(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine (PubChem CID 105213683) has the molecular formula C9H9BrN2OS and a molecular weight of 273.16 g/mol. Its IUPAC name is [(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine
PubChem CID105213683
Molecular FormulaC9H9BrN2OS
Molecular Weight273.16 g/mol
Exact Mass271.96
IUPAC Name[(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine
SMILESNNC(c1ccco1)c1sccc1Br
InChIInChI=1S/C9H9BrN2OS/c10-6-3-5-14-9(6)8(12-11)7-2-1-4-13-7/h1-5,8,12H,11H2
InChIKeyAVUKWFJQDPNDNS-UHFFFAOYSA-N
XLogP2.66
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.16
LogP ≤ 52.66
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 [(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine?
The IUPAC name of [(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine (CID 105213683) is [(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine?
The canonical SMILES for [(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine is NNC(c1ccco1)c1sccc1Br.
What is the InChIKey of [(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine?
The InChIKey is AVUKWFJQDPNDNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9BrN2OS/c10-6-3-5-14-9(6)8(12-11)7-2-1-4-13-7/h1-5,8,12H,11H2.
What are the key properties of [(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine?
[(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine has a molecular weight of 273.16 g/mol, XLogP of 2.66, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromothiophen-2-yl)-(furan-2-yl)methyl]hydrazine is sourced from PubChem (CID 105213683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).