O-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine

C8H17FN2O — CID 167131702

IUPACO-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine
SMILESNOCCCN1CCC(F)CC1
InChIInChI=1S/C8H17FN2O/c9-8-2-5-11(6-3-8)4-1-7-12-10/h8H,1-7,10H2
InChIKeyOHIRIDGWOOCLKH-UHFFFAOYSA-N
MW176.23 g/mol
LogP0.70
Rot. Bonds4

About O-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine

O-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine (PubChem CID 167131702) has the molecular formula C8H17FN2O and a molecular weight of 176.23 g/mol. Its IUPAC name is O-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine.

Molecular Properties

Compound NameO-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine
PubChem CID167131702
Molecular FormulaC8H17FN2O
Molecular Weight176.23 g/mol
Exact Mass176.13
IUPAC NameO-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine
SMILESNOCCCN1CCC(F)CC1
InChIInChI=1S/C8H17FN2O/c9-8-2-5-11(6-3-8)4-1-7-12-10/h8H,1-7,10H2
InChIKeyOHIRIDGWOOCLKH-UHFFFAOYSA-N
XLogP0.70
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.23
LogP ≤ 50.70
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

O-(3-fluoro-1-methylpiperidin-4-yl)hydroxylamine
CID 124200952
O-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]hydroxylamine
CID 129267514
4-Fluoro-1-(3-methoxypropyl)piperidine
CID 137458763
4-Fluoro-1-(3-sulfanyloxypropyl)piperidine
CID 139446862
O-[(4S)-3-fluoro-1-methylpiperidin-4-yl]hydroxylamine
CID 139498103
3-Piperidin-1-ylpropyl hypofluorite
CID 141990635
O-[3-(4,4-difluoropiperidin-1-yl)propyl]hydroxylamine
CID 142527856
N-[3-(4,4-difluoropiperidin-1-yl)propoxy]methanamine
CID 145311490
1-(3-Ethoxypropyl)-4-fluoropiperidine
CID 146393734
3-(4-Fluoropiperidin-1-yl)propyl hypoiodite
CID 146481893
4-Fluoro-1-(3-hydroperoxypropyl)piperidine
CID 146482007
1-[3-(Trifluoromethoxy)propyl]piperidine
CID 154073929

Frequently Asked Questions

What is the IUPAC name of O-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine?
The IUPAC name of O-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine (CID 167131702) is O-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine.
What is the SMILES notation for O-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine?
The canonical SMILES for O-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine is NOCCCN1CCC(F)CC1.
What is the InChIKey of O-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine?
The InChIKey is OHIRIDGWOOCLKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17FN2O/c9-8-2-5-11(6-3-8)4-1-7-12-10/h8H,1-7,10H2.
What are the key properties of O-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine?
O-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine has a molecular weight of 176.23 g/mol, XLogP of 0.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[3-(4-fluoropiperidin-1-yl)propyl]hydroxylamine is sourced from PubChem (CID 167131702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).