[1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine

C14H17BrN2O — CID 105287279

IUPAC[1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
SMILESCc1cc(C)cc(CC(NN)c2ccc(Br)o2)c1
InChIInChI=1S/C14H17BrN2O/c1-9-5-10(2)7-11(6-9)8-12(17-16)13-3-4-14(15)18-13/h3-7,12,17H,8,16H2,1-2H3
InChIKeyULMSADHUEUYTQV-UHFFFAOYSA-N
MW309.21 g/mol
LogP3.41
Rot. Bonds4

About [1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine

[1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine (PubChem CID 105287279) has the molecular formula C14H17BrN2O and a molecular weight of 309.21 g/mol. Its IUPAC name is [1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
PubChem CID105287279
Molecular FormulaC14H17BrN2O
Molecular Weight309.21 g/mol
Exact Mass308.05
IUPAC Name[1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
SMILESCc1cc(C)cc(CC(NN)c2ccc(Br)o2)c1
InChIInChI=1S/C14H17BrN2O/c1-9-5-10(2)7-11(6-9)8-12(17-16)13-3-4-14(15)18-13/h3-7,12,17H,8,16H2,1-2H3
InChIKeyULMSADHUEUYTQV-UHFFFAOYSA-N
XLogP3.41
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.21
LogP ≤ 53.41
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

[2-(3,5-dimethylphenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine
CID 105287242
[1-(5-bromofuran-2-yl)-2-(5-bromo-3-pyridinyl)ethyl]hydrazine
CID 105334847
[1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105295409
[2-(3,5-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine
CID 105212586
[(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105286828
[1-(3,5-dibromophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 107978906
[1-(5-bromofuran-2-yl)-2-(5-ethylthiophen-2-yl)ethyl]hydrazine
CID 105296487
1-(5-bromofuran-2-yl)-N-ethyl-2-(3-methylphenyl)ethanamine
CID 55067944
[1-(5-bromofuran-2-yl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 105321933
[1-(5-bromofuran-2-yl)-2-(5-bromo-2-methoxyphenyl)ethyl]hydrazine
CID 105290206
[1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 105280879
[1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 114027312

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine (CID 105287279) is [1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine is Cc1cc(C)cc(CC(NN)c2ccc(Br)o2)c1.
What is the InChIKey of [1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
The InChIKey is ULMSADHUEUYTQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17BrN2O/c1-9-5-10(2)7-11(6-9)8-12(17-16)13-3-4-14(15)18-13/h3-7,12,17H,8,16H2,1-2H3.
What are the key properties of [1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
[1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine has a molecular weight of 309.21 g/mol, XLogP of 3.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105287279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).