[2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine

C14H15N3O — CID 105196662

IUPAC[2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine
SMILESNNC(c1ccncc1)c1cccc2c1OCC2
InChIInChI=1S/C14H15N3O/c15-17-13(10-4-7-16-8-5-10)12-3-1-2-11-6-9-18-14(11)12/h1-5,7-8,13,17H,6,9,15H2
InChIKeyUPQJZOKPJSWAML-UHFFFAOYSA-N
MW241.29 g/mol
LogP1.57
Rot. Bonds3

About [2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine

[2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine (PubChem CID 105196662) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is [2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine
PubChem CID105196662
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name[2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine
SMILESNNC(c1ccncc1)c1cccc2c1OCC2
InChIInChI=1S/C14H15N3O/c15-17-13(10-4-7-16-8-5-10)12-3-1-2-11-6-9-18-14(11)12/h1-5,7-8,13,17H,6,9,15H2
InChIKeyUPQJZOKPJSWAML-UHFFFAOYSA-N
XLogP1.57
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 51.57
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 [2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine?
The IUPAC name of [2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine (CID 105196662) is [2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine.
What is the SMILES notation for [2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine?
The canonical SMILES for [2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine is NNC(c1ccncc1)c1cccc2c1OCC2.
What is the InChIKey of [2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine?
The InChIKey is UPQJZOKPJSWAML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c15-17-13(10-4-7-16-8-5-10)12-3-1-2-11-6-9-18-14(11)12/h1-5,7-8,13,17H,6,9,15H2.
What are the key properties of [2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine?
[2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine has a molecular weight of 241.29 g/mol, XLogP of 1.57, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2,3-dihydro-1-benzofuran-7-yl(pyridin-4-yl)methyl]hydrazine is sourced from PubChem (CID 105196662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).