[(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine

C13H14Br2N2S — CID 107970220

IUPAC[(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine
SMILESCc1cccc(C(NN)c2cc(Br)sc2Br)c1C
InChIInChI=1S/C13H14Br2N2S/c1-7-4-3-5-9(8(7)2)12(17-16)10-6-11(14)18-13(10)15/h3-6,12,17H,16H2,1-2H3
InChIKeyRIOJPQUMYYBIGZ-UHFFFAOYSA-N
MW390.14 g/mol
LogP4.44
Rot. Bonds3

About [(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine

[(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine (PubChem CID 107970220) has the molecular formula C13H14Br2N2S and a molecular weight of 390.14 g/mol. Its IUPAC name is [(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine
PubChem CID107970220
Molecular FormulaC13H14Br2N2S
Molecular Weight390.14 g/mol
Exact Mass387.92
IUPAC Name[(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine
SMILESCc1cccc(C(NN)c2cc(Br)sc2Br)c1C
InChIInChI=1S/C13H14Br2N2S/c1-7-4-3-5-9(8(7)2)12(17-16)10-6-11(14)18-13(10)15/h3-6,12,17H,16H2,1-2H3
InChIKeyRIOJPQUMYYBIGZ-UHFFFAOYSA-N
XLogP4.44
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.14
LogP ≤ 54.44
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

1-(2,5-dibromothiophen-3-yl)-1-(2,3-dimethylphenyl)-N-methylmethanamine
CID 43486963
[(2,5-dibromothiophen-3-yl)-naphthalen-1-ylmethyl]hydrazine
CID 107970229
[(2,5-dibromothiophen-3-yl)-(2,3-difluoro-4-methylphenyl)methyl]hydrazine
CID 107970741
[(2,5-dibromothiophen-3-yl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 107970684
[(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 107970496
[(2-bromo-3-fluorophenyl)-(2,3-dimethylphenyl)methyl]hydrazine
CID 105300521
[(2,5-dibromothiophen-3-yl)-(2,6-difluorophenyl)methyl]hydrazine
CID 107970307
[1-(2,5-dibromothiophen-3-yl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
CID 107970529
[(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine
CID 107970581
[(2,5-dimethylfuran-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine
CID 105300529
[(2,3-dimethylphenyl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
CID 105291474
[(2,3-dimethylphenyl)-pyrimidin-2-ylmethyl]hydrazine
CID 105203580

Frequently Asked Questions

What is the IUPAC name of [(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine?
The IUPAC name of [(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine (CID 107970220) is [(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine.
What is the SMILES notation for [(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine?
The canonical SMILES for [(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine is Cc1cccc(C(NN)c2cc(Br)sc2Br)c1C.
What is the InChIKey of [(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine?
The InChIKey is RIOJPQUMYYBIGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14Br2N2S/c1-7-4-3-5-9(8(7)2)12(17-16)10-6-11(14)18-13(10)15/h3-6,12,17H,16H2,1-2H3.
What are the key properties of [(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine?
[(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine has a molecular weight of 390.14 g/mol, XLogP of 4.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,5-dibromothiophen-3-yl)-(2,3-dimethylphenyl)methyl]hydrazine is sourced from PubChem (CID 107970220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).