2-(2-fluorophenoxy)-1-phenylethanamine

C14H14FNO — CID 16782769

IUPAC2-(2-fluorophenoxy)-1-phenylethanamine
SMILESNC(COc1ccccc1F)c1ccccc1
InChIInChI=1S/C14H14FNO/c15-12-8-4-5-9-14(12)17-10-13(16)11-6-2-1-3-7-11/h1-9,13H,10,16H2
InChIKeyYQMXYMOZEVGKEC-UHFFFAOYSA-N
MW231.27 g/mol
LogP2.90
Rot. Bonds4

About 2-(2-fluorophenoxy)-1-phenylethanamine

2-(2-fluorophenoxy)-1-phenylethanamine (PubChem CID 16782769) has the molecular formula C14H14FNO and a molecular weight of 231.27 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-1-phenylethanamine.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-1-phenylethanamine
PubChem CID16782769
Molecular FormulaC14H14FNO
Molecular Weight231.27 g/mol
Exact Mass231.11
IUPAC Name2-(2-fluorophenoxy)-1-phenylethanamine
SMILESNC(COc1ccccc1F)c1ccccc1
InChIInChI=1S/C14H14FNO/c15-12-8-4-5-9-14(12)17-10-13(16)11-6-2-1-3-7-11/h1-9,13H,10,16H2
InChIKeyYQMXYMOZEVGKEC-UHFFFAOYSA-N
XLogP2.90
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.27
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-fluorophenoxy)-1-(4-fluorophenyl)ethanamine
CID 16784701
2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine
CID 18070424
2-(5-bromo-2-fluorophenoxy)-1-phenylethanamine
CID 114673476
(1S)-2-[2-(4-chlorophenoxy)-3-fluorophenoxy]-1-phenylethanamine
CID 134158095
(1S)-2-(2-methylphenoxy)-1-phenylethanamine;hydrochloride
CID 164614673
1-(2,2-difluoroethoxy)-2-fluorobenzene
CID 64766194
2-(3,4-difluorophenoxy)-1-phenylethanamine
CID 63772754
2-(2-ethylphenoxy)-1-phenylethanamine;hydrochloride
CID 162317712
2-(4-bromo-3-fluorophenoxy)-1-phenylethanamine
CID 65203757
1-(4-fluorophenyl)-2-phenoxyethanamine;hydrochloride
CID 138991019
(1S)-2-phenoxy-1-phenylethanamine;hydrochloride
CID 131882540
3-amino-N-[2-(2-fluorophenoxy)-1-phenylethyl]butanamide;hydrochloride
CID 119735720

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-1-phenylethanamine?
The IUPAC name of 2-(2-fluorophenoxy)-1-phenylethanamine (CID 16782769) is 2-(2-fluorophenoxy)-1-phenylethanamine.
What is the SMILES notation for 2-(2-fluorophenoxy)-1-phenylethanamine?
The canonical SMILES for 2-(2-fluorophenoxy)-1-phenylethanamine is NC(COc1ccccc1F)c1ccccc1.
What is the InChIKey of 2-(2-fluorophenoxy)-1-phenylethanamine?
The InChIKey is YQMXYMOZEVGKEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO/c15-12-8-4-5-9-14(12)17-10-13(16)11-6-2-1-3-7-11/h1-9,13H,10,16H2.
What are the key properties of 2-(2-fluorophenoxy)-1-phenylethanamine?
2-(2-fluorophenoxy)-1-phenylethanamine has a molecular weight of 231.27 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-1-phenylethanamine is sourced from PubChem (CID 16782769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).