N-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine

C8H11F2NO2 — CID 163295061

IUPACN-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine
SMILESON=C1CCC2(CC1)OCC2(F)F
InChIInChI=1S/C8H11F2NO2/c9-8(10)5-13-7(8)3-1-6(11-12)2-4-7/h12H,1-5H2/b11-6-
InChIKeyPRRRVDOXEQBNCR-WDZFZDKYSA-N
MW191.18 g/mol
LogP1.79
Rot. Bonds

About N-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine

N-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine (PubChem CID 163295061) has the molecular formula C8H11F2NO2 and a molecular weight of 191.18 g/mol. Its IUPAC name is N-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine
PubChem CID163295061
Molecular FormulaC8H11F2NO2
Molecular Weight191.18 g/mol
Exact Mass191.08
IUPAC NameN-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine
SMILESON=C1CCC2(CC1)OCC2(F)F
InChIInChI=1S/C8H11F2NO2/c9-8(10)5-13-7(8)3-1-6(11-12)2-4-7/h12H,1-5H2/b11-6-
InChIKeyPRRRVDOXEQBNCR-WDZFZDKYSA-N
XLogP1.79
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.18
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(3,4-difluoro-1-oxaspiro[4.5]decan-8-ylidene)hydroxylamine
CID 163294757
N-(4,4-difluoro-1-oxaspiro[4.5]decan-8-ylidene)hydroxylamine
CID 163294780
1-(1,1-Difluoro-2-hydroxyethyl)-4-hydroxyiminocyclohexan-1-ol
CID 163294829
1-(1,1-Difluoro-2-methoxyethyl)-4-hydroxyiminocyclohexan-1-ol
CID 163294894
1-(1,1-Difluoro-3-methoxypropyl)-4-hydroxyiminocyclohexan-1-ol
CID 163295074

Frequently Asked Questions

What is the IUPAC name of N-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine?
The IUPAC name of N-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine (CID 163295061) is N-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine.
What is the SMILES notation for N-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine?
The canonical SMILES for N-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine is ON=C1CCC2(CC1)OCC2(F)F.
What is the InChIKey of N-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine?
The InChIKey is PRRRVDOXEQBNCR-WDZFZDKYSA-N. The full InChI is InChI=1S/C8H11F2NO2/c9-8(10)5-13-7(8)3-1-6(11-12)2-4-7/h12H,1-5H2/b11-6-.
What are the key properties of N-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine?
N-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine has a molecular weight of 191.18 g/mol, XLogP of 1.79, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-difluoro-1-oxaspiro[3.5]nonan-7-ylidene)hydroxylamine is sourced from PubChem (CID 163295061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).