N-[3-(trifluoromethyl)cyclohexyl]hydroxylamine

C7H12F3NO — CID 82685484

IUPACN-[3-(trifluoromethyl)cyclohexyl]hydroxylamine
SMILESONC1CCCC(C(F)(F)F)C1
InChIInChI=1S/C7H12F3NO/c8-7(9,10)5-2-1-3-6(4-5)11-12/h5-6,11-12H,1-4H2
InChIKeyOAIZUIQCURXDNG-UHFFFAOYSA-N
MW183.17 g/mol
LogP2.09
Rot. Bonds1

About N-[3-(trifluoromethyl)cyclohexyl]hydroxylamine

N-[3-(trifluoromethyl)cyclohexyl]hydroxylamine (PubChem CID 82685484) has the molecular formula C7H12F3NO and a molecular weight of 183.17 g/mol. Its IUPAC name is N-[3-(trifluoromethyl)cyclohexyl]hydroxylamine.

Molecular Properties

Compound NameN-[3-(trifluoromethyl)cyclohexyl]hydroxylamine
PubChem CID82685484
Molecular FormulaC7H12F3NO
Molecular Weight183.17 g/mol
Exact Mass183.09
IUPAC NameN-[3-(trifluoromethyl)cyclohexyl]hydroxylamine
SMILESONC1CCCC(C(F)(F)F)C1
InChIInChI=1S/C7H12F3NO/c8-7(9,10)5-2-1-3-6(4-5)11-12/h5-6,11-12H,1-4H2
InChIKeyOAIZUIQCURXDNG-UHFFFAOYSA-N
XLogP2.09
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(Trifluoromethyl)cyclohexylamine (cis-and trans-mixture)
CID 16227766
rac-(1R,3S)-3-(trifluoromethyl)cyclohexan-1-amine hydrochloride
CID 90019632
(1S,3R)-3-(trifluoromethyl)cyclohexan-1-amine
CID 40799879
3-(Difluoromethyl)cyclohexan-1-amine
CID 84716388
rac-(1R,3R)-3-(trifluoromethyl)cyclohexan-1-amine hydrochloride
CID 132327565
3-(Trifluoromethyl)cyclohexanamine hydrochloride
CID 18769889
(1R,3R)-3-(Trifluoromethyl)cyclohexan-1-amine
CID 25323569
(1R,3S)-3-(Trifluoromethyl)cyclohexanamine
CID 40799875
(1S,3S)-3-(trifluoromethyl)cyclohexan-1-amine
CID 40799877
3-(Trifluoromethyl)cyclohexanaminium chloride
CID 68970808
(1R)-3-(trifluoromethyl)cyclohexan-1-amine
CID 134459178
N-[(4,4-difluorocyclohexyl)methyl]hydroxylamine
CID 138508066

Frequently Asked Questions

What is the IUPAC name of N-[3-(trifluoromethyl)cyclohexyl]hydroxylamine?
The IUPAC name of N-[3-(trifluoromethyl)cyclohexyl]hydroxylamine (CID 82685484) is N-[3-(trifluoromethyl)cyclohexyl]hydroxylamine.
What is the SMILES notation for N-[3-(trifluoromethyl)cyclohexyl]hydroxylamine?
The canonical SMILES for N-[3-(trifluoromethyl)cyclohexyl]hydroxylamine is ONC1CCCC(C(F)(F)F)C1.
What is the InChIKey of N-[3-(trifluoromethyl)cyclohexyl]hydroxylamine?
The InChIKey is OAIZUIQCURXDNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F3NO/c8-7(9,10)5-2-1-3-6(4-5)11-12/h5-6,11-12H,1-4H2.
What are the key properties of N-[3-(trifluoromethyl)cyclohexyl]hydroxylamine?
N-[3-(trifluoromethyl)cyclohexyl]hydroxylamine has a molecular weight of 183.17 g/mol, XLogP of 2.09, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(trifluoromethyl)cyclohexyl]hydroxylamine is sourced from PubChem (CID 82685484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).