[1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine

C14H18N2O2 — CID 105198804

IUPAC[1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine
SMILESNNC(CC1CCCO1)c1cc2ccccc2o1
InChIInChI=1S/C14H18N2O2/c15-16-12(9-11-5-3-7-17-11)14-8-10-4-1-2-6-13(10)18-14/h1-2,4,6,8,11-12,16H,3,5,7,9,15H2
InChIKeyKVJSWOROQQMJOC-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.51
Rot. Bonds4

About [1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine

[1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine (PubChem CID 105198804) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is [1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine
PubChem CID105198804
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name[1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine
SMILESNNC(CC1CCCO1)c1cc2ccccc2o1
InChIInChI=1S/C14H18N2O2/c15-16-12(9-11-5-3-7-17-11)14-8-10-4-1-2-6-13(10)18-14/h1-2,4,6,8,11-12,16H,3,5,7,9,15H2
InChIKeyKVJSWOROQQMJOC-UHFFFAOYSA-N
XLogP2.51
TPSA60.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.51
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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Frequently Asked Questions

What is the IUPAC name of [1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine?
The IUPAC name of [1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine (CID 105198804) is [1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine?
The canonical SMILES for [1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine is NNC(CC1CCCO1)c1cc2ccccc2o1.
What is the InChIKey of [1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine?
The InChIKey is KVJSWOROQQMJOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c15-16-12(9-11-5-3-7-17-11)14-8-10-4-1-2-6-13(10)18-14/h1-2,4,6,8,11-12,16H,3,5,7,9,15H2.
What are the key properties of [1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine?
[1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine has a molecular weight of 246.31 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-benzofuran-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105198804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).