[(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine

C14H11BrClN3O — CID 105268152

IUPAC[(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine
SMILESNNC(c1cc2cccc(Cl)c2o1)c1ncccc1Br
InChIInChI=1S/C14H11BrClN3O/c15-9-4-2-6-18-12(9)13(19-17)11-7-8-3-1-5-10(16)14(8)20-11/h1-7,13,19H,17H2
InChIKeyWXOLLBDOFRMMKV-UHFFFAOYSA-N
MW352.62 g/mol
LogP3.80
Rot. Bonds3

About [(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine

[(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine (PubChem CID 105268152) has the molecular formula C14H11BrClN3O and a molecular weight of 352.62 g/mol. Its IUPAC name is [(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine
PubChem CID105268152
Molecular FormulaC14H11BrClN3O
Molecular Weight352.62 g/mol
Exact Mass350.98
IUPAC Name[(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine
SMILESNNC(c1cc2cccc(Cl)c2o1)c1ncccc1Br
InChIInChI=1S/C14H11BrClN3O/c15-9-4-2-6-18-12(9)13(19-17)11-7-8-3-1-5-10(16)14(8)20-11/h1-7,13,19H,17H2
InChIKeyWXOLLBDOFRMMKV-UHFFFAOYSA-N
XLogP3.80
TPSA64.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.62
LogP ≤ 53.80
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

[(3-bromo-2-chlorophenyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine
CID 105339723
[(5-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine
CID 105267826
[(7-chloro-1-benzofuran-2-yl)-(2-methyl-4-pyridinyl)methyl]hydrazine
CID 106756721
[(2-bromo-3-methylphenyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine
CID 107986198
N-[(3-bromo-2-pyridinyl)-(7-methyl-1-benzofuran-2-yl)methyl]ethanamine
CID 114730903
[(7-chloro-1-benzofuran-2-yl)-(3-chloro-2-methylphenyl)methyl]hydrazine
CID 107103839
[(7-bromo-1-benzofuran-2-yl)-(2,5-dichlorophenyl)methyl]hydrazine
CID 105301983
[(7-chloro-1-benzofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105339711
[(7-chloro-1-benzofuran-2-yl)-thiophen-2-ylmethyl]hydrazine
CID 105193697
[(3-bromo-2-pyridinyl)-(3-chloro-4-methylphenyl)methyl]hydrazine
CID 107562462
1-(3-chloro-2-pyridinyl)-1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine
CID 103444169
[(3,5-dichloro-2-pyridinyl)-(7-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105248604

Frequently Asked Questions

What is the IUPAC name of [(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine?
The IUPAC name of [(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine (CID 105268152) is [(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine?
The canonical SMILES for [(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine is NNC(c1cc2cccc(Cl)c2o1)c1ncccc1Br.
What is the InChIKey of [(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine?
The InChIKey is WXOLLBDOFRMMKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClN3O/c15-9-4-2-6-18-12(9)13(19-17)11-7-8-3-1-5-10(16)14(8)20-11/h1-7,13,19H,17H2.
What are the key properties of [(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine?
[(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine has a molecular weight of 352.62 g/mol, XLogP of 3.80, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methyl]hydrazine is sourced from PubChem (CID 105268152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).