1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine

C15H20N2O — CID 105311268

IUPAC1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine
SMILESC=CCCCC(NN)c1cc2cc(C)ccc2o1
InChIInChI=1S/C15H20N2O/c1-3-4-5-6-13(17-16)15-10-12-9-11(2)7-8-14(12)18-15/h3,7-10,13,17H,1,4-6,16H2,2H3
InChIKeyVHZOOGNRPJTGIB-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.60
Rot. Bonds6

About 1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine

1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine (PubChem CID 105311268) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine.

Molecular Properties

Compound Name1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine
PubChem CID105311268
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine
SMILESC=CCCCC(NN)c1cc2cc(C)ccc2o1
InChIInChI=1S/C15H20N2O/c1-3-4-5-6-13(17-16)15-10-12-9-11(2)7-8-14(12)18-15/h3,7-10,13,17H,1,4-6,16H2,2H3
InChIKeyVHZOOGNRPJTGIB-UHFFFAOYSA-N
XLogP3.60
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.60
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-(5-methyl-1-benzofuran-2-yl)but-3-enylhydrazine
CID 105269594
[3-ethoxy-1-(5-methyl-1-benzofuran-2-yl)propyl]hydrazine
CID 105338315
[2-ethoxy-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine
CID 105235203
N-methyl-1-(5-methyl-1-benzofuran-2-yl)heptan-1-amine
CID 105045111
[1-(5-methyl-1-benzofuran-2-yl)-2-(2-methylphenyl)ethyl]hydrazine
CID 105208272
1-(1-benzofuran-2-yl)-N-propyloct-7-en-1-amine
CID 107009087
[2-cyclopentylsulfanyl-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine
CID 105227379
[1-(5-methyl-1-benzofuran-2-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
CID 103217797
[1-(5-methyl-1-benzofuran-2-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 105214131
[2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine
CID 105324027
1-(5-methyl-1-benzofuran-2-yl)propan-1-amine
CID 65440376
N-ethyl-1-(5-methyl-1-benzofuran-2-yl)hex-5-yn-1-amine
CID 105179544

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine?
The IUPAC name of 1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine (CID 105311268) is 1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine.
What is the SMILES notation for 1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine?
The canonical SMILES for 1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine is C=CCCCC(NN)c1cc2cc(C)ccc2o1.
What is the InChIKey of 1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine?
The InChIKey is VHZOOGNRPJTGIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-3-4-5-6-13(17-16)15-10-12-9-11(2)7-8-14(12)18-15/h3,7-10,13,17H,1,4-6,16H2,2H3.
What are the key properties of 1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine?
1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine has a molecular weight of 244.34 g/mol, XLogP of 3.60, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-1-benzofuran-2-yl)hex-5-enylhydrazine is sourced from PubChem (CID 105311268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).