N-(4-fluorobutyl)hydroxylamine

C4H10FNO — CID 55264278

IUPACN-(4-fluorobutyl)hydroxylamine
SMILESONCCCCF
InChIInChI=1S/C4H10FNO/c5-3-1-2-4-6-7/h6-7H,1-4H2
InChIKeyQATVZDNRWFOOJP-UHFFFAOYSA-N
MW107.13 g/mol
LogP0.71
Rot. Bonds4

About N-(4-fluorobutyl)hydroxylamine

N-(4-fluorobutyl)hydroxylamine (PubChem CID 55264278) has the molecular formula C4H10FNO and a molecular weight of 107.13 g/mol. Its IUPAC name is N-(4-fluorobutyl)hydroxylamine.

Molecular Properties

Compound NameN-(4-fluorobutyl)hydroxylamine
PubChem CID55264278
Molecular FormulaC4H10FNO
Molecular Weight107.13 g/mol
Exact Mass107.07
IUPAC NameN-(4-fluorobutyl)hydroxylamine
SMILESONCCCCF
InChIInChI=1S/C4H10FNO/c5-3-1-2-4-6-7/h6-7H,1-4H2
InChIKeyQATVZDNRWFOOJP-UHFFFAOYSA-N
XLogP0.71
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.13
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorobutyl)hydroxylamine?
The IUPAC name of N-(4-fluorobutyl)hydroxylamine (CID 55264278) is N-(4-fluorobutyl)hydroxylamine.
What is the SMILES notation for N-(4-fluorobutyl)hydroxylamine?
The canonical SMILES for N-(4-fluorobutyl)hydroxylamine is ONCCCCF.
What is the InChIKey of N-(4-fluorobutyl)hydroxylamine?
The InChIKey is QATVZDNRWFOOJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10FNO/c5-3-1-2-4-6-7/h6-7H,1-4H2.
What are the key properties of N-(4-fluorobutyl)hydroxylamine?
N-(4-fluorobutyl)hydroxylamine has a molecular weight of 107.13 g/mol, XLogP of 0.71, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorobutyl)hydroxylamine is sourced from PubChem (CID 55264278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).