1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine

C14H20N2O — CID 105311312

IUPAC1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine
SMILESC=CCCCC(NN)c1ccc2c(c1)CCO2
InChIInChI=1S/C14H20N2O/c1-2-3-4-5-13(16-15)11-6-7-14-12(10-11)8-9-17-14/h2,6-7,10,13,16H,1,3-5,8-9,15H2
InChIKeyOHMIAWNDGQEQKE-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.48
Rot. Bonds6

About 1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine

1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine (PubChem CID 105311312) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine.

Molecular Properties

Compound Name1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine
PubChem CID105311312
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine
SMILESC=CCCCC(NN)c1ccc2c(c1)CCO2
InChIInChI=1S/C14H20N2O/c1-2-3-4-5-13(16-15)11-6-7-14-12(10-11)8-9-17-14/h2,6-7,10,13,16H,1,3-5,8-9,15H2
InChIKeyOHMIAWNDGQEQKE-UHFFFAOYSA-N
XLogP2.48
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.48
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': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(2,3-dihydro-1-benzofuran-5-yl)decylhydrazine
CID 105293354
[1-(2,3-dihydro-1-benzofuran-5-yl)-5,5,5-trifluoropentyl]hydrazine
CID 105328955
1-(2,3-dihydro-1-benzofuran-5-yl)hex-4-ynylhydrazine
CID 105334999
[1-(2,3-dihydro-1-benzofuran-5-yl)-2-(oxolan-2-yl)ethyl]hydrazine
CID 105198767
[3-(2,2-difluoroethoxy)-1-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydrazine
CID 103151844
1-(2,3-dihydro-1-benzofuran-5-yl)pent-3-ynylhydrazine
CID 105290659
1-(2,3-dihydro-1-benzofuran-5-yl)but-3-en-1-ol
CID 79734096
[1-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methylpropylsulfanyl)ethyl]hydrazine
CID 105226954
1-(2,3-dihydro-1-benzofuran-5-yl)-N-methylnonan-1-amine
CID 65450080
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyloct-7-en-1-amine
CID 107011502
[2-butan-2-ylsulfanyl-1-(2,3-dihydro-1-benzofuran-5-yl)ethyl]hydrazine
CID 105227304
1-(3-chloro-4-fluorophenyl)hex-5-enylhydrazine
CID 105218048

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine?
The IUPAC name of 1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine (CID 105311312) is 1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine.
What is the SMILES notation for 1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine?
The canonical SMILES for 1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine is C=CCCCC(NN)c1ccc2c(c1)CCO2.
What is the InChIKey of 1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine?
The InChIKey is OHMIAWNDGQEQKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-2-3-4-5-13(16-15)11-6-7-14-12(10-11)8-9-17-14/h2,6-7,10,13,16H,1,3-5,8-9,15H2.
What are the key properties of 1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine?
1-(2,3-dihydro-1-benzofuran-5-yl)hex-5-enylhydrazine has a molecular weight of 232.33 g/mol, XLogP of 2.48, 6 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-5-yl)hex-5-enylhydrazine is sourced from PubChem (CID 105311312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).