N-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine

C13H18FNO — CID 117320222

IUPACN-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine
SMILESONCc1ccc(C2CCCCC2)c(F)c1
InChIInChI=1S/C13H18FNO/c14-13-8-10(9-15-16)6-7-12(13)11-4-2-1-3-5-11/h6-8,11,15-16H,1-5,9H2
InChIKeyLOSVZMHYLHMMRX-UHFFFAOYSA-N
MW223.29 g/mol
LogP3.35
Rot. Bonds3

About N-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine

N-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine (PubChem CID 117320222) has the molecular formula C13H18FNO and a molecular weight of 223.29 g/mol. Its IUPAC name is N-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine.

Molecular Properties

Compound NameN-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine
PubChem CID117320222
Molecular FormulaC13H18FNO
Molecular Weight223.29 g/mol
Exact Mass223.14
IUPAC NameN-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine
SMILESONCc1ccc(C2CCCCC2)c(F)c1
InChIInChI=1S/C13H18FNO/c14-13-8-10(9-15-16)6-7-12(13)11-4-2-1-3-5-11/h6-8,11,15-16H,1-5,9H2
InChIKeyLOSVZMHYLHMMRX-UHFFFAOYSA-N
XLogP3.35
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.29
LogP ≤ 53.35
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-(4-cyclohexyl-3-fluorophenyl)propan-1-ol
CID 117345509
N-[(4-cyclopentylphenyl)methyl]hydroxylamine
CID 117282542
(4-cyclopropyl-3-fluorophenyl)methanol;ethane
CID 144930453
4-chloro-1-cyclopentyl-2-fluorobenzene
CID 66685145
4-bromo-1-cyclopentyl-2-fluorobenzene
CID 122471293
1-(4-cyclohexyl-3-fluorophenyl)cyclopropan-1-ol
CID 117340858
1-(3-bromo-4-cyclohexylphenyl)-N-methoxymethanamine
CID 117480345
4-cyclohexyl-5-fluorobenzene-1,2-diol
CID 90391034
N-[(3-bromo-4-fluorophenyl)methyl]hydroxylamine
CID 82686499
1-[(4-cyclopropyl-3-fluorophenyl)methyl]cyclopropan-1-amine
CID 117293738
[4-cyclohexyl-3-(trifluoromethyl)phenyl]-dideuteriomethanol
CID 140961429
N-[(4-chloro-3-fluorophenyl)methyl]-1-cyclohexylmethanamine
CID 63423058

Frequently Asked Questions

What is the IUPAC name of N-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine?
The IUPAC name of N-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine (CID 117320222) is N-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine.
What is the SMILES notation for N-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine?
The canonical SMILES for N-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine is ONCc1ccc(C2CCCCC2)c(F)c1.
What is the InChIKey of N-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine?
The InChIKey is LOSVZMHYLHMMRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FNO/c14-13-8-10(9-15-16)6-7-12(13)11-4-2-1-3-5-11/h6-8,11,15-16H,1-5,9H2.
What are the key properties of N-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine?
N-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine has a molecular weight of 223.29 g/mol, XLogP of 3.35, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine is sourced from PubChem (CID 117320222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).