1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine

C15H24N2O — CID 105262982

IUPAC1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine
SMILESCCCCCCC(NN)C1Cc2ccccc2O1
InChIInChI=1S/C15H24N2O/c1-2-3-4-5-9-13(17-16)15-11-12-8-6-7-10-14(12)18-15/h6-8,10,13,15,17H,2-5,9,11,16H2,1H3
InChIKeyYXAVKYXZZVJGOO-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.79
Rot. Bonds7

About 1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine

1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine (PubChem CID 105262982) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine.

Molecular Properties

Compound Name1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine
PubChem CID105262982
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine
SMILESCCCCCCC(NN)C1Cc2ccccc2O1
InChIInChI=1S/C15H24N2O/c1-2-3-4-5-9-13(17-16)15-11-12-8-6-7-10-14(12)18-15/h6-8,10,13,15,17H,2-5,9,11,16H2,1H3
InChIKeyYXAVKYXZZVJGOO-UHFFFAOYSA-N
XLogP2.79
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine?
The IUPAC name of 1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine (CID 105262982) is 1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine.
What is the SMILES notation for 1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine?
The canonical SMILES for 1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine is CCCCCCC(NN)C1Cc2ccccc2O1.
What is the InChIKey of 1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine?
The InChIKey is YXAVKYXZZVJGOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-2-3-4-5-9-13(17-16)15-11-12-8-6-7-10-14(12)18-15/h6-8,10,13,15,17H,2-5,9,11,16H2,1H3.
What are the key properties of 1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine?
1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine has a molecular weight of 248.37 g/mol, XLogP of 2.79, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine is sourced from PubChem (CID 105262982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).