N-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine

C10H14FNO2 — CID 84775253

IUPACN-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine
SMILESCN(O)Cc1ccc(OCCF)cc1
InChIInChI=1S/C10H14FNO2/c1-12(13)8-9-2-4-10(5-3-9)14-7-6-11/h2-5,13H,6-8H2,1H3
InChIKeyMNTJKXFFNZSSBY-UHFFFAOYSA-N
MW199.22 g/mol
LogP1.86
Rot. Bonds5

About N-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine

N-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine (PubChem CID 84775253) has the molecular formula C10H14FNO2 and a molecular weight of 199.22 g/mol. Its IUPAC name is N-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine.

Molecular Properties

Compound NameN-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine
PubChem CID84775253
Molecular FormulaC10H14FNO2
Molecular Weight199.22 g/mol
Exact Mass199.10
IUPAC NameN-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine
SMILESCN(O)Cc1ccc(OCCF)cc1
InChIInChI=1S/C10H14FNO2/c1-12(13)8-9-2-4-10(5-3-9)14-7-6-11/h2-5,13H,6-8H2,1H3
InChIKeyMNTJKXFFNZSSBY-UHFFFAOYSA-N
XLogP1.86
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.22
LogP ≤ 51.86
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

1-(2-(18F)fluoroethoxy)-4-[(4-methoxyphenoxy)methyl]benzene
CID 127026687
ethane;1-(2-fluoroethoxy)-4-methylbenzene
CID 142309231
1-[4-(2-fluoroethoxy)phenyl]ethanol
CID 80502586
1-[4-(2-methoxyethoxy)phenyl]-N,N-dimethylmethanamine
CID 166879761
16-[4-(2-(18F)fluoroethoxy)phenyl]hexadecan-2-one
CID 87414721
1-(4-butoxyphenyl)-N-methanidyl-N-methylmethanamine
CID 59280482
N,N-diethyl-2-[N-[[4-(2-fluoroethoxy)phenyl]methyl]-3,5-dimethylanilino]acetamide
CID 162675483
1-chloro-4-[[4-(2-fluoroethoxy)phenyl]methoxymethyl]benzene
CID 13367652
2-[4-[2-(dimethylamino)ethoxy]phenyl]ethanol
CID 83390498
4-(2-fluoroethoxy)benzenesulfinic acid
CID 123969802
(2R)-2-amino-3-[4-(2-(18F)fluoroethoxy)phenyl]propanoic acid
CID 11499578
1-[4-(3-fluoropropoxy)phenyl]propan-2-ol
CID 115495812

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine?
The IUPAC name of N-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine (CID 84775253) is N-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine.
What is the SMILES notation for N-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine?
The canonical SMILES for N-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine is CN(O)Cc1ccc(OCCF)cc1.
What is the InChIKey of N-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine?
The InChIKey is MNTJKXFFNZSSBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO2/c1-12(13)8-9-2-4-10(5-3-9)14-7-6-11/h2-5,13H,6-8H2,1H3.
What are the key properties of N-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine?
N-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine has a molecular weight of 199.22 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-fluoroethoxy)phenyl]methyl]-N-methylhydroxylamine is sourced from PubChem (CID 84775253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).