[2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine

C15H15BrN2OS — CID 105299502

IUPAC[2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine
SMILESCc1ccc2oc(C(Cc3sccc3Br)NN)cc2c1
InChIInChI=1S/C15H15BrN2OS/c1-9-2-3-13-10(6-9)7-14(19-13)12(18-17)8-15-11(16)4-5-20-15/h2-7,12,18H,8,17H2,1H3
InChIKeyTUUAOEFNIYQEIC-UHFFFAOYSA-N
MW351.27 g/mol
LogP4.31
Rot. Bonds4

About [2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine

[2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine (PubChem CID 105299502) has the molecular formula C15H15BrN2OS and a molecular weight of 351.27 g/mol. Its IUPAC name is [2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine
PubChem CID105299502
Molecular FormulaC15H15BrN2OS
Molecular Weight351.27 g/mol
Exact Mass350.01
IUPAC Name[2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine
SMILESCc1ccc2oc(C(Cc3sccc3Br)NN)cc2c1
InChIInChI=1S/C15H15BrN2OS/c1-9-2-3-13-10(6-9)7-14(19-13)12(18-17)8-15-11(16)4-5-20-15/h2-7,12,18H,8,17H2,1H3
InChIKeyTUUAOEFNIYQEIC-UHFFFAOYSA-N
XLogP4.31
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.27
LogP ≤ 54.31
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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Related Compounds

[2-(3-bromothiophen-2-yl)-1-(3,5-dimethylphenyl)ethyl]hydrazine
CID 105299572
[1-(5-methyl-1-benzofuran-2-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 105214131
[2-(3-bromothiophen-2-yl)-1-(2-fluoro-4-methylphenyl)ethyl]hydrazine
CID 105299497
[2-(3-bromothiophen-2-yl)-1-(3-methylphenyl)ethyl]hydrazine
CID 105200816
[1-(5-methyl-1-benzofuran-2-yl)-2-(2-methylphenyl)ethyl]hydrazine
CID 105208272
[2-(3-bromothiophen-2-yl)-1-(5-methylfuran-3-yl)ethyl]hydrazine
CID 105299564
[1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine
CID 105316478
N-[(3-bromothiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]propan-1-amine
CID 105045202
1,2-bis(3-bromothiophen-2-yl)ethylhydrazine
CID 105299585
1-(5-methyl-1-benzofuran-2-yl)but-3-enylhydrazine
CID 105269594
[(4-bromothiophen-3-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105322592
[2-ethoxy-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine
CID 105235203

Frequently Asked Questions

What is the IUPAC name of [2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine (CID 105299502) is [2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine is Cc1ccc2oc(C(Cc3sccc3Br)NN)cc2c1.
What is the InChIKey of [2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine?
The InChIKey is TUUAOEFNIYQEIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2OS/c1-9-2-3-13-10(6-9)7-14(19-13)12(18-17)8-15-11(16)4-5-20-15/h2-7,12,18H,8,17H2,1H3.
What are the key properties of [2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine?
[2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine has a molecular weight of 351.27 g/mol, XLogP of 4.31, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105299502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).