N-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine

C8H10FNO2 — CID 123875503

IUPACN-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine
SMILESCOc1ccc(N(C)O)c(F)c1
InChIInChI=1S/C8H10FNO2/c1-10(11)8-4-3-6(12-2)5-7(8)9/h3-5,11H,1-2H3
InChIKeyOLSHRNDOSOEZNN-UHFFFAOYSA-N
MW171.17 g/mol
LogP1.66
Rot. Bonds2

About N-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine

N-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine (PubChem CID 123875503) has the molecular formula C8H10FNO2 and a molecular weight of 171.17 g/mol. Its IUPAC name is N-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine.

Molecular Properties

Compound NameN-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine
PubChem CID123875503
Molecular FormulaC8H10FNO2
Molecular Weight171.17 g/mol
Exact Mass171.07
IUPAC NameN-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine
SMILESCOc1ccc(N(C)O)c(F)c1
InChIInChI=1S/C8H10FNO2/c1-10(11)8-4-3-6(12-2)5-7(8)9/h3-5,11H,1-2H3
InChIKeyOLSHRNDOSOEZNN-UHFFFAOYSA-N
XLogP1.66
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.17
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,N,2-trifluoro-4-methoxyaniline
CID 87910530
N-(2-fluoro-4-methoxyphenyl)-N,1-dimethylpiperidin-4-amine
CID 110454587
2-fluoro-4-methoxyaniline
CID 3756383
bis(2-fluoro-4-methoxyphenyl)methanol
CID 102884350
2-[(2-fluoro-4-methoxyphenyl)methyl-methylamino]acetic acid
CID 102877379
2-(dimethylamino)-1-(2-fluoro-4-methoxyphenyl)ethanone
CID 103694166
2-fluoro-N-[2-[(2-fluoro-4-methoxybenzoyl)-methylamino]cyclohexyl]-4-methoxy-N-methylbenzamide
CID 166182143
2-fluoro-N,N-dimethyl-4-(trifluoromethoxy)aniline
CID 118847370
(2-fluoro-4-methoxyphenyl)methyl-methylazanide
CID 89077895
1,2-difluoro-4-methoxybenzene;oxolane
CID 174837143
1-(1-chloroethenyl)-2-fluoro-4-methoxybenzene
CID 126581039
2-hydroxysulfanyl-4-methoxyphenol
CID 143396910

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine?
The IUPAC name of N-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine (CID 123875503) is N-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine.
What is the SMILES notation for N-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine?
The canonical SMILES for N-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine is COc1ccc(N(C)O)c(F)c1.
What is the InChIKey of N-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine?
The InChIKey is OLSHRNDOSOEZNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO2/c1-10(11)8-4-3-6(12-2)5-7(8)9/h3-5,11H,1-2H3.
What are the key properties of N-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine?
N-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine has a molecular weight of 171.17 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-4-methoxyphenyl)-N-methylhydroxylamine is sourced from PubChem (CID 123875503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).