[(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine

C14H17BrN2O2 — CID 106859886

IUPAC[(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine
SMILESCCCOc1ccc(C(NN)c2ccoc2Br)cc1
InChIInChI=1S/C14H17BrN2O2/c1-2-8-18-11-5-3-10(4-6-11)13(17-16)12-7-9-19-14(12)15/h3-7,9,13,17H,2,8,16H2,1H3
InChIKeyAFCRBHDWLPRFJP-UHFFFAOYSA-N
MW325.21 g/mol
LogP3.38
Rot. Bonds6

About [(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine

[(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine (PubChem CID 106859886) has the molecular formula C14H17BrN2O2 and a molecular weight of 325.21 g/mol. Its IUPAC name is [(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine
PubChem CID106859886
Molecular FormulaC14H17BrN2O2
Molecular Weight325.21 g/mol
Exact Mass324.05
IUPAC Name[(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine
SMILESCCCOc1ccc(C(NN)c2ccoc2Br)cc1
InChIInChI=1S/C14H17BrN2O2/c1-2-8-18-11-5-3-10(4-6-11)13(17-16)12-7-9-19-14(12)15/h3-7,9,13,17H,2,8,16H2,1H3
InChIKeyAFCRBHDWLPRFJP-UHFFFAOYSA-N
XLogP3.38
TPSA60.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.21
LogP ≤ 53.38
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-bromo-5-fluorophenyl)-(4-propoxyphenyl)methyl]hydrazine
CID 105303709
[(2-bromo-4-fluorophenyl)-(4-propoxyphenyl)methyl]hydrazine
CID 105303658
N-[(2-bromofuran-3-yl)-(4-methoxyphenyl)methyl]propan-1-amine
CID 106851671
[(2-bromofuran-3-yl)-(3,5-dimethoxyphenyl)methyl]hydrazine
CID 106860090
[(2,5-dimethylphenyl)-(4-propoxyphenyl)methyl]hydrazine
CID 105303653
[(4-butoxyphenyl)-(2-chlorophenyl)methyl]hydrazine
CID 105287427
(2-bromofuran-3-yl)-(4-ethoxyphenyl)methanol
CID 106855309
[(5-methylpyrimidin-2-yl)-(4-propoxyphenyl)methyl]hydrazine
CID 105261658
[(4-butoxyphenyl)-(4-chlorophenyl)methyl]hydrazine
CID 105281210
[(5-fluoro-2-pyridinyl)-(4-propoxyphenyl)methyl]hydrazine
CID 105248508
[(3-methoxyphenyl)-(4-propoxyphenyl)methyl]hydrazine
CID 105191804
[(5-chlorothiophen-2-yl)-(4-propoxyphenyl)methyl]hydrazine
CID 105303654

Frequently Asked Questions

What is the IUPAC name of [(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine?
The IUPAC name of [(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine (CID 106859886) is [(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine is CCCOc1ccc(C(NN)c2ccoc2Br)cc1.
What is the InChIKey of [(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine?
The InChIKey is AFCRBHDWLPRFJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17BrN2O2/c1-2-8-18-11-5-3-10(4-6-11)13(17-16)12-7-9-19-14(12)15/h3-7,9,13,17H,2,8,16H2,1H3.
What are the key properties of [(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine?
[(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine has a molecular weight of 325.21 g/mol, XLogP of 3.38, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromofuran-3-yl)-(4-propoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 106859886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).