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

C13H15FN2O2 — CID 105229222

IUPAC[(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine
SMILESNNC(c1cc2cccc(F)c2o1)C1CCCO1
InChIInChI=1S/C13H15FN2O2/c14-9-4-1-3-8-7-11(18-13(8)9)12(16-15)10-5-2-6-17-10/h1,3-4,7,10,12,16H,2,5-6,15H2
InChIKeyBSNSQARGCJPWKV-UHFFFAOYSA-N
MW250.27 g/mol
LogP2.26
Rot. Bonds3

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

[(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine (PubChem CID 105229222) has the molecular formula C13H15FN2O2 and a molecular weight of 250.27 g/mol. Its IUPAC name is [(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine
PubChem CID105229222
Molecular FormulaC13H15FN2O2
Molecular Weight250.27 g/mol
Exact Mass250.11
IUPAC Name[(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine
SMILESNNC(c1cc2cccc(F)c2o1)C1CCCO1
InChIInChI=1S/C13H15FN2O2/c14-9-4-1-3-8-7-11(18-13(8)9)12(16-15)10-5-2-6-17-10/h1,3-4,7,10,12,16H,2,5-6,15H2
InChIKeyBSNSQARGCJPWKV-UHFFFAOYSA-N
XLogP2.26
TPSA60.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.27
LogP ≤ 52.26
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

[(7-fluoro-1-benzofuran-2-yl)-(oxan-2-yl)methyl]hydrazine
CID 105339231
[cyclopentyl-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105204500
[7-bicyclo[4.1.0]heptanyl-(7-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105339280
[2-cyclopropyl-1-(7-fluoro-1-benzofuran-2-yl)propyl]hydrazine
CID 105339223
N-[(7-chloro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]propan-1-amine
CID 114729105
1-(7-fluoro-1-benzofuran-2-yl)-3-(oxolan-2-yl)propan-1-ol
CID 115836935
2-(1,3-dioxolan-2-yl)-1-(7-fluoro-1-benzofuran-2-yl)ethanamine
CID 103544181
N-[cyclopentyl-(7-fluoro-1-benzofuran-2-yl)methyl]propan-1-amine
CID 114727995
[(7-fluoro-1-benzofuran-2-yl)-(1-methylcyclopropyl)methyl]hydrazine
CID 105253565
[oxolan-2-yl(quinolin-8-yl)methyl]hydrazine
CID 105228946
[(7-chloro-1-benzofuran-2-yl)-(oxan-4-yl)methyl]hydrazine
CID 105229716
2-(7-fluoro-1-benzofuran-2-yl)-2-hydrazinyl-N,N-dimethylethanamine
CID 105244926

Frequently Asked Questions

What is the IUPAC name of [(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine?
The IUPAC name of [(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine (CID 105229222) is [(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine.
What is the SMILES notation for [(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine?
The canonical SMILES for [(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine is NNC(c1cc2cccc(F)c2o1)C1CCCO1.
What is the InChIKey of [(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine?
The InChIKey is BSNSQARGCJPWKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN2O2/c14-9-4-1-3-8-7-11(18-13(8)9)12(16-15)10-5-2-6-17-10/h1,3-4,7,10,12,16H,2,5-6,15H2.
What are the key properties of [(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine?
[(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine has a molecular weight of 250.27 g/mol, XLogP of 2.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(7-fluoro-1-benzofuran-2-yl)-(oxolan-2-yl)methyl]hydrazine is sourced from PubChem (CID 105229222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).