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

4-[(3,3-difluorocyclopentyl)methoxy]-3-methoxyaniline
CID 114223611
1-(3,3-difluorocyclopentyl)-2-methylpropan-2-ol
CID 130487394
1-[2-(3,3-difluorocyclopentyl)ethyl]cyclopropan-1-amine
CID 105443651
2-(3,3-difluorocyclopentyl)ethanol
CID 58879048
1-[(3,3-difluorocyclopentyl)methoxy]-2-fluoro-3-methylbenzene
CID 114225343
2-(3,3-difluorocyclopentyl)-N'-hydroxyethanimidamide
CID 142465564
methyl (2S)-2-[[(1S)-3,3-difluorocyclopentyl]methyl]butanoate
CID 58484957
(3,3-difluorocyclopentyl)methanol;ethyl 3,3-difluorocyclopentane-1-carboxylate
CID 158542629
1-(3,3-difluorocyclopentyl)propan-2-ol
CID 130487406
3-amino-1-(3,3-difluorocyclopentyl)butan-2-ol
CID 164658398
3-(2-chloro-3-methylbutyl)-1,1-difluorocyclopentane
CID 130487711
2-amino-3-(3,3-difluorocyclopentyl)propanamide
CID 130487339

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).