[(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine

C13H11ClN2O2 — CID 105221236

IUPAC[(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine
SMILESNNC(c1ccoc1)c1cc2cc(Cl)ccc2o1
InChIInChI=1S/C13H11ClN2O2/c14-10-1-2-11-9(5-10)6-12(18-11)13(16-15)8-3-4-17-7-8/h1-7,13,16H,15H2
InChIKeyOYRFOSKYNJRGJZ-UHFFFAOYSA-N
MW262.70 g/mol
LogP3.23
Rot. Bonds3

About [(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine

[(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine (PubChem CID 105221236) has the molecular formula C13H11ClN2O2 and a molecular weight of 262.70 g/mol. Its IUPAC name is [(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine
PubChem CID105221236
Molecular FormulaC13H11ClN2O2
Molecular Weight262.70 g/mol
Exact Mass262.05
IUPAC Name[(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine
SMILESNNC(c1ccoc1)c1cc2cc(Cl)ccc2o1
InChIInChI=1S/C13H11ClN2O2/c14-10-1-2-11-9(5-10)6-12(18-11)13(16-15)8-3-4-17-7-8/h1-7,13,16H,15H2
InChIKeyOYRFOSKYNJRGJZ-UHFFFAOYSA-N
XLogP3.23
TPSA64.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.70
LogP ≤ 53.23
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

[(5-chloro-1-benzofuran-2-yl)-(3,5-difluorophenyl)methyl]hydrazine
CID 105207773
[(3-bromo-5-chlorophenyl)-(5-chloro-1-benzofuran-2-yl)methyl]hydrazine
CID 107948526
[(5-chloro-1-benzofuran-2-yl)-(3-chloro-4-methylphenyl)methyl]hydrazine
CID 105338541
5-chloro-2-[(5-chloro-1-benzofuran-2-yl)-hydrazinylmethyl]aniline
CID 105224051
[(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine
CID 105338577
[(3-chlorophenyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105194545
[(5-chloro-1-benzofuran-2-yl)-(3-chloro-2-fluorophenyl)methyl]hydrazine
CID 105223265
[(5-chloro-1-benzofuran-2-yl)-(3,5-dichloro-2-pyridinyl)methyl]hydrazine
CID 105248605
[(5-chloro-1-benzofuran-2-yl)-(3-methyl-2-pyridinyl)methyl]hydrazine
CID 105209118
1-(5-chloro-1-benzofuran-2-yl)-N-methyl-1-(4-methylphenyl)methanamine
CID 114727660
[(4-chloro-3-fluorophenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 107997332
[2-chloro-1-(5-chloro-1-benzofuran-2-yl)-2,2-difluoroethyl]hydrazine
CID 105265344

Frequently Asked Questions

What is the IUPAC name of [(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine?
The IUPAC name of [(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine (CID 105221236) is [(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine.
What is the SMILES notation for [(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine?
The canonical SMILES for [(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine is NNC(c1ccoc1)c1cc2cc(Cl)ccc2o1.
What is the InChIKey of [(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine?
The InChIKey is OYRFOSKYNJRGJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2O2/c14-10-1-2-11-9(5-10)6-12(18-11)13(16-15)8-3-4-17-7-8/h1-7,13,16H,15H2.
What are the key properties of [(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine?
[(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine has a molecular weight of 262.70 g/mol, XLogP of 3.23, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine is sourced from PubChem (CID 105221236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).