[(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine

C11H12BrClN2O — CID 102654296

IUPAC[(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine
SMILESNNC(C1=CCCO1)c1ccc(Cl)c(Br)c1
InChIInChI=1S/C11H12BrClN2O/c12-8-6-7(3-4-9(8)13)11(15-14)10-2-1-5-16-10/h2-4,6,11,15H,1,5,14H2
InChIKeyKEONTTOSGTYDEM-UHFFFAOYSA-N
MW303.59 g/mol
LogP2.91
Rot. Bonds3

About [(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine

[(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine (PubChem CID 102654296) has the molecular formula C11H12BrClN2O and a molecular weight of 303.59 g/mol. Its IUPAC name is [(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine
PubChem CID102654296
Molecular FormulaC11H12BrClN2O
Molecular Weight303.59 g/mol
Exact Mass301.98
IUPAC Name[(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine
SMILESNNC(C1=CCCO1)c1ccc(Cl)c(Br)c1
InChIInChI=1S/C11H12BrClN2O/c12-8-6-7(3-4-9(8)13)11(15-14)10-2-1-5-16-10/h2-4,6,11,15H,1,5,14H2
InChIKeyKEONTTOSGTYDEM-UHFFFAOYSA-N
XLogP2.91
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.59
LogP ≤ 52.91
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

[(3-chloro-4-fluorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine
CID 102654140
[(3-bromo-4-chlorophenyl)-(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]hydrazine
CID 105261083
[(3-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine
CID 105261003
[2,3-dihydrofuran-5-yl(pyridin-4-yl)methyl]hydrazine
CID 102654057
1-(3,4-dichlorophenyl)-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine
CID 102652031
[2,3-dihydrofuran-5-yl-(3,5-dimethylphenyl)methyl]hydrazine
CID 102654461
[(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine
CID 105261045
[(3-bromo-4-chlorophenyl)-(4-tert-butylphenyl)methyl]hydrazine
CID 105261121
[(3-bromo-4-chlorophenyl)-(4-methoxyphenyl)methyl]hydrazine
CID 105260984
[(3,4-difluorophenyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
CID 102649888
(4-bromo-3-chlorophenyl)-(2,3-dihydrofuran-5-yl)methanol
CID 102653924
[2,3-dihydrofuran-5-yl-(5-iodothiophen-3-yl)methyl]hydrazine
CID 102654366

Frequently Asked Questions

What is the IUPAC name of [(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine?
The IUPAC name of [(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine (CID 102654296) is [(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine.
What is the SMILES notation for [(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine?
The canonical SMILES for [(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine is NNC(C1=CCCO1)c1ccc(Cl)c(Br)c1.
What is the InChIKey of [(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine?
The InChIKey is KEONTTOSGTYDEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12BrClN2O/c12-8-6-7(3-4-9(8)13)11(15-14)10-2-1-5-16-10/h2-4,6,11,15H,1,5,14H2.
What are the key properties of [(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine?
[(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine has a molecular weight of 303.59 g/mol, XLogP of 2.91, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine is sourced from PubChem (CID 102654296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).