N-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine

C5H9NO2 — CID 142652674

IUPACN-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine
SMILESONC1CCC=CO1
InChIInChI=1S/C5H9NO2/c7-6-5-3-1-2-4-8-5/h2,4-7H,1,3H2
InChIKeyZXYACBRQANVGQB-UHFFFAOYSA-N
MW115.13 g/mol
LogP0.62
Rot. Bonds1

About N-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine

N-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine (PubChem CID 142652674) has the molecular formula C5H9NO2 and a molecular weight of 115.13 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine
PubChem CID142652674
Molecular FormulaC5H9NO2
Molecular Weight115.13 g/mol
Exact Mass115.06
IUPAC NameN-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine
SMILESONC1CCC=CO1
InChIInChI=1S/C5H9NO2/c7-6-5-3-1-2-4-8-5/h2,4-7H,1,3H2
InChIKeyZXYACBRQANVGQB-UHFFFAOYSA-N
XLogP0.62
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.13
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine?
The IUPAC name of N-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine (CID 142652674) is N-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine.
What is the SMILES notation for N-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine?
The canonical SMILES for N-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine is ONC1CCC=CO1.
What is the InChIKey of N-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine?
The InChIKey is ZXYACBRQANVGQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO2/c7-6-5-3-1-2-4-8-5/h2,4-7H,1,3H2.
What are the key properties of N-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine?
N-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine has a molecular weight of 115.13 g/mol, XLogP of 0.62, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-pyran-2-yl)hydroxylamine is sourced from PubChem (CID 142652674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).