O-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine

C11H15NO2 — CID 83698233

IUPACO-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine
SMILESNOCCCc1ccc2c(c1)CCO2
InChIInChI=1S/C11H15NO2/c12-14-6-1-2-9-3-4-11-10(8-9)5-7-13-11/h3-4,8H,1-2,5-7,12H2
InChIKeyAVINIXVJAJTHHU-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.44
Rot. Bonds4

About O-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine

O-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine (PubChem CID 83698233) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is O-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine.

Molecular Properties

Compound NameO-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine
PubChem CID83698233
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC NameO-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine
SMILESNOCCCc1ccc2c(c1)CCO2
InChIInChI=1S/C11H15NO2/c12-14-6-1-2-9-3-4-11-10(8-9)5-7-13-11/h3-4,8H,1-2,5-7,12H2
InChIKeyAVINIXVJAJTHHU-UHFFFAOYSA-N
XLogP1.44
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]ethane-1,2-diamine
CID 65444450
3-(2,3-dihydro-1-benzofuran-5-yl)-N-ethylpropan-1-amine
CID 65446095
1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-methylpropan-2-amine
CID 65444502
N'-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-N'-methylmethanediamine
CID 115226278
1-(2,3-dihydro-1-benzofuran-5-yl)-5-methylhexan-3-amine
CID 65446268
5-(2,3-dihydro-1-benzofuran-5-yl)-3-methylpentan-1-amine
CID 65300933
7-(2,3-dihydro-1-benzofuran-5-yl)-N,2-dimethylheptan-3-amine
CID 65442850
5-(2-isocyanoethyl)-2,3-dihydro-1-benzofuran
CID 83481552
2,3-dihydro-1-benzofuran-5-ylmethanethiol
CID 79885132
2,3-dihydro-1-benzofuran-5-ylmethylazanium
CID 6932006
5-(chloromethyl)-2,3-dihydro-1-benzofuran
CID 11789614
N-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-2-methylpropan-2-amine
CID 64866852

Frequently Asked Questions

What is the IUPAC name of O-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine?
The IUPAC name of O-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine (CID 83698233) is O-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine.
What is the SMILES notation for O-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine?
The canonical SMILES for O-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine is NOCCCc1ccc2c(c1)CCO2.
What is the InChIKey of O-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine?
The InChIKey is AVINIXVJAJTHHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c12-14-6-1-2-9-3-4-11-10(8-9)5-7-13-11/h3-4,8H,1-2,5-7,12H2.
What are the key properties of O-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine?
O-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine has a molecular weight of 193.25 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[3-(2,3-dihydro-1-benzofuran-5-yl)propyl]hydroxylamine is sourced from PubChem (CID 83698233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).