[(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine

C13H15BrN2O3 — CID 106860090

IUPAC[(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine
SMILESCOc1cc(OC)cc(C(NN)c2ccoc2Br)c1
InChIInChI=1S/C13H15BrN2O3/c1-17-9-5-8(6-10(7-9)18-2)12(16-15)11-3-4-19-13(11)14/h3-7,12,16H,15H2,1-2H3
InChIKeyDMVDHMFTOINOOD-UHFFFAOYSA-N
MW327.18 g/mol
LogP2.61
Rot. Bonds5

About [(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine

[(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine (PubChem CID 106860090) has the molecular formula C13H15BrN2O3 and a molecular weight of 327.18 g/mol. Its IUPAC name is [(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine
PubChem CID106860090
Molecular FormulaC13H15BrN2O3
Molecular Weight327.18 g/mol
Exact Mass326.03
IUPAC Name[(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine
SMILESCOc1cc(OC)cc(C(NN)c2ccoc2Br)c1
InChIInChI=1S/C13H15BrN2O3/c1-17-9-5-8(6-10(7-9)18-2)12(16-15)11-3-4-19-13(11)14/h3-7,12,16H,15H2,1-2H3
InChIKeyDMVDHMFTOINOOD-UHFFFAOYSA-N
XLogP2.61
TPSA69.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.18
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine
CID 106859886
1-(2-bromofuran-3-yl)-1-(4-methoxy-2-methylphenyl)-N-methylmethanamine
CID 106851550
N-[(2-bromofuran-3-yl)-(3-methoxyphenyl)methyl]ethanamine
CID 106856912
[(3,5-dimethoxyphenyl)-(2,5-dimethylphenyl)methyl]hydrazine
CID 105292640
N-[(2-bromofuran-3-yl)-(4-methoxyphenyl)methyl]propan-1-amine
CID 106851671
[(2-bromophenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105208659
[(3,5-dimethoxyphenyl)-pyridin-2-ylmethyl]hydrazine
CID 105195951
[(2-bromofuran-3-yl)-(4-bromo-1-methylpyrazol-5-yl)methyl]hydrazine
CID 106860278
N-[(3,5-dimethoxyphenyl)-(2-methylfuran-3-yl)methyl]ethanamine
CID 104790226
(2-bromofuran-3-yl)-(6-methoxynaphthalen-2-yl)methanamine
CID 106851764
[(3,5-dimethoxyphenyl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
CID 105258685
[(5-bromo-3-pyridinyl)-(3,5-dimethoxyphenyl)methyl]hydrazine
CID 105251245

Frequently Asked Questions

What is the IUPAC name of [(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine?
The IUPAC name of [(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine (CID 106860090) is [(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine is COc1cc(OC)cc(C(NN)c2ccoc2Br)c1.
What is the InChIKey of [(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine?
The InChIKey is DMVDHMFTOINOOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15BrN2O3/c1-17-9-5-8(6-10(7-9)18-2)12(16-15)11-3-4-19-13(11)14/h3-7,12,16H,15H2,1-2H3.
What are the key properties of [(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine?
[(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine has a molecular weight of 327.18 g/mol, XLogP of 2.61, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 106860090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).