[(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine

C16H15FN2O — CID 105200864

IUPAC[(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine
SMILESCc1cccc(C(NN)c2cc3cccc(F)c3o2)c1
InChIInChI=1S/C16H15FN2O/c1-10-4-2-5-11(8-10)15(19-18)14-9-12-6-3-7-13(17)16(12)20-14/h2-9,15,19H,18H2,1H3
InChIKeyDMDVFBFNCQKISP-UHFFFAOYSA-N
MW270.31 g/mol
LogP3.43
Rot. Bonds3

About [(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine

[(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine (PubChem CID 105200864) has the molecular formula C16H15FN2O and a molecular weight of 270.31 g/mol. Its IUPAC name is [(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine
PubChem CID105200864
Molecular FormulaC16H15FN2O
Molecular Weight270.31 g/mol
Exact Mass270.12
IUPAC Name[(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine
SMILESCc1cccc(C(NN)c2cc3cccc(F)c3o2)c1
InChIInChI=1S/C16H15FN2O/c1-10-4-2-5-11(8-10)15(19-18)14-9-12-6-3-7-13(17)16(12)20-14/h2-9,15,19H,18H2,1H3
InChIKeyDMDVFBFNCQKISP-UHFFFAOYSA-N
XLogP3.43
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.31
LogP ≤ 53.43
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

[(3,4-dichlorophenyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105257216
[(7-fluoro-1-benzofuran-2-yl)-(4-methoxyphenyl)methyl]hydrazine
CID 105190989
[(3,5-dichlorophenyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105339255
[(3-bromo-5-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105238779
[(3,5-dimethyl-2-pyridinyl)-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105266541
[(7-chloro-1-benzofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105339711
[(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
CID 105258723
[(7-fluoro-1-benzofuran-2-yl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine
CID 105230636
1-(2-bromo-4-methylphenyl)-1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine
CID 105047461
1-(7-fluoro-1-benzofuran-2-yl)-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
CID 114728621
2-(7-fluoro-1-benzofuran-2-yl)-2-hydrazinyl-N,N-dimethylethanamine
CID 105244926
[(4-bromo-3-methylphenyl)-(7-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105338351

Frequently Asked Questions

What is the IUPAC name of [(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine?
The IUPAC name of [(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine (CID 105200864) is [(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine?
The canonical SMILES for [(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine is Cc1cccc(C(NN)c2cc3cccc(F)c3o2)c1.
What is the InChIKey of [(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine?
The InChIKey is DMDVFBFNCQKISP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O/c1-10-4-2-5-11(8-10)15(19-18)14-9-12-6-3-7-13(17)16(12)20-14/h2-9,15,19H,18H2,1H3.
What are the key properties of [(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine?
[(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine has a molecular weight of 270.31 g/mol, XLogP of 3.43, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(7-fluoro-1-benzofuran-2-yl)-(3-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 105200864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).