O-[(3,3-difluorocyclopentyl)methyl]hydroxylamine

C6H11F2NO — CID 126974531

IUPACO-[(3,3-difluorocyclopentyl)methyl]hydroxylamine
SMILESNOCC1CCC(F)(F)C1
InChIInChI=1S/C6H11F2NO/c7-6(8)2-1-5(3-6)4-10-9/h5H,1-4,9H2
InChIKeyZSEAYSRGQAMEJD-UHFFFAOYSA-N
MW151.16 g/mol
LogP1.31
Rot. Bonds2

About O-[(3,3-difluorocyclopentyl)methyl]hydroxylamine

O-[(3,3-difluorocyclopentyl)methyl]hydroxylamine (PubChem CID 126974531) has the molecular formula C6H11F2NO and a molecular weight of 151.16 g/mol. Its IUPAC name is O-[(3,3-difluorocyclopentyl)methyl]hydroxylamine.

Molecular Properties

Compound NameO-[(3,3-difluorocyclopentyl)methyl]hydroxylamine
PubChem CID126974531
Molecular FormulaC6H11F2NO
Molecular Weight151.16 g/mol
Exact Mass151.08
IUPAC NameO-[(3,3-difluorocyclopentyl)methyl]hydroxylamine
SMILESNOCC1CCC(F)(F)C1
InChIInChI=1S/C6H11F2NO/c7-6(8)2-1-5(3-6)4-10-9/h5H,1-4,9H2
InChIKeyZSEAYSRGQAMEJD-UHFFFAOYSA-N
XLogP1.31
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

O-(cyclopentylmethyl)hydroxylamine
CID 21414879
1,1-Difluoro-3-(methoxymethyl)cyclopentane
CID 121390808
1,1-Difluoro-3-(sulfanyloxymethyl)cyclopentane
CID 123610559
O-(4,4-difluoro-5-methylhexyl)hydroxylamine
CID 129154004
(3,3-Difluorocyclopentyl)methoxy thiohypoiodite
CID 145225635
O-(2-cyclopentyl-2-fluoroethyl)hydroxylamine
CID 115011726
O-(2-cyclobutyl-2,2-difluoroethyl)hydroxylamine
CID 115011809
O-(2-cyclopentyl-2,2-difluoroethyl)hydroxylamine
CID 115013019
O-[2-(3,3-difluorocyclobutyl)ethyl]hydroxylamine
CID 165840213

Frequently Asked Questions

What is the IUPAC name of O-[(3,3-difluorocyclopentyl)methyl]hydroxylamine?
The IUPAC name of O-[(3,3-difluorocyclopentyl)methyl]hydroxylamine (CID 126974531) is O-[(3,3-difluorocyclopentyl)methyl]hydroxylamine.
What is the SMILES notation for O-[(3,3-difluorocyclopentyl)methyl]hydroxylamine?
The canonical SMILES for O-[(3,3-difluorocyclopentyl)methyl]hydroxylamine is NOCC1CCC(F)(F)C1.
What is the InChIKey of O-[(3,3-difluorocyclopentyl)methyl]hydroxylamine?
The InChIKey is ZSEAYSRGQAMEJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2NO/c7-6(8)2-1-5(3-6)4-10-9/h5H,1-4,9H2.
What are the key properties of O-[(3,3-difluorocyclopentyl)methyl]hydroxylamine?
O-[(3,3-difluorocyclopentyl)methyl]hydroxylamine has a molecular weight of 151.16 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-[(3,3-difluorocyclopentyl)methyl]hydroxylamine is sourced from PubChem (CID 126974531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).