2-fluoro-3-(4-methoxyphenoxy)propan-1-amine

C10H14FNO2 — CID 105452034

IUPAC2-fluoro-3-(4-methoxyphenoxy)propan-1-amine
SMILESCOc1ccc(OCC(F)CN)cc1
InChIInChI=1S/C10H14FNO2/c1-13-9-2-4-10(5-3-9)14-7-8(11)6-12/h2-5,8H,6-7,12H2,1H3
InChIKeyWASNZEVCQGYJKB-UHFFFAOYSA-N
MW199.23 g/mol
LogP1.37
Rot. Bonds5

About 2-fluoro-3-(4-methoxyphenoxy)propan-1-amine

2-fluoro-3-(4-methoxyphenoxy)propan-1-amine (PubChem CID 105452034) has the molecular formula C10H14FNO2 and a molecular weight of 199.23 g/mol. Its IUPAC name is 2-fluoro-3-(4-methoxyphenoxy)propan-1-amine.

Molecular Properties

Compound Name2-fluoro-3-(4-methoxyphenoxy)propan-1-amine
PubChem CID105452034
Molecular FormulaC10H14FNO2
Molecular Weight199.23 g/mol
Exact Mass199.10
IUPAC Name2-fluoro-3-(4-methoxyphenoxy)propan-1-amine
SMILESCOc1ccc(OCC(F)CN)cc1
InChIInChI=1S/C10H14FNO2/c1-13-9-2-4-10(5-3-9)14-7-8(11)6-12/h2-5,8H,6-7,12H2,1H3
InChIKeyWASNZEVCQGYJKB-UHFFFAOYSA-N
XLogP1.37
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.23
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-fluoro-3-(4-methoxyphenoxy)propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-fluoro-3-(4-methoxyphenyl)propan-1-amine
CID 84718779
(2S)-1-(4-methoxyphenoxy)propan-2-amine
CID 7263362
methyl 2-bromo-3-(4-methoxyphenoxy)propanoate
CID 81091606
(4-methoxyphenoxy)methanol
CID 20580272
3-(4-methoxyphenoxy)-2-pyridin-2-ylpropan-1-amine
CID 112516627
2-(4-methoxyphenyl)propane-1,3-diamine
CID 20546608
3,3-difluoro-2-[(4-methoxyphenyl)methyl]propan-1-amine
CID 84723743
methyl 2-[(4-methoxyphenoxy)methyl]-4-methylpentanoate
CID 117242247
[3-[(2R)-3-amino-2-fluoropropoxy]-5-methylphenyl]methanol
CID 118527436
(4-methoxyphenyl)-[4-(2-methylpropoxy)phenyl]methanone
CID 5023093
4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol
CID 117244685
2-[2-(4-methoxyphenoxy)ethylsulfanyl]propan-1-amine
CID 66218381

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-(4-methoxyphenoxy)propan-1-amine?
The IUPAC name of 2-fluoro-3-(4-methoxyphenoxy)propan-1-amine (CID 105452034) is 2-fluoro-3-(4-methoxyphenoxy)propan-1-amine.
What is the SMILES notation for 2-fluoro-3-(4-methoxyphenoxy)propan-1-amine?
The canonical SMILES for 2-fluoro-3-(4-methoxyphenoxy)propan-1-amine is COc1ccc(OCC(F)CN)cc1.
What is the InChIKey of 2-fluoro-3-(4-methoxyphenoxy)propan-1-amine?
The InChIKey is WASNZEVCQGYJKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO2/c1-13-9-2-4-10(5-3-9)14-7-8(11)6-12/h2-5,8H,6-7,12H2,1H3.
What are the key properties of 2-fluoro-3-(4-methoxyphenoxy)propan-1-amine?
2-fluoro-3-(4-methoxyphenoxy)propan-1-amine has a molecular weight of 199.23 g/mol, XLogP of 1.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-(4-methoxyphenoxy)propan-1-amine is sourced from PubChem (CID 105452034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).