1-(2-ethoxy-5-fluorophenyl)propan-2-amine

C11H16FNO — CID 55254144

IUPAC1-(2-ethoxy-5-fluorophenyl)propan-2-amine
SMILESCCOc1ccc(F)cc1CC(C)N
InChIInChI=1S/C11H16FNO/c1-3-14-11-5-4-10(12)7-9(11)6-8(2)13/h4-5,7-8H,3,6,13H2,1-2H3
InChIKeyRLGAVPQHXYOBTC-UHFFFAOYSA-N
MW197.25 g/mol
LogP2.11
Rot. Bonds4

About 1-(2-ethoxy-5-fluorophenyl)propan-2-amine

1-(2-ethoxy-5-fluorophenyl)propan-2-amine (PubChem CID 55254144) has the molecular formula C11H16FNO and a molecular weight of 197.25 g/mol. Its IUPAC name is 1-(2-ethoxy-5-fluorophenyl)propan-2-amine.

Molecular Properties

Compound Name1-(2-ethoxy-5-fluorophenyl)propan-2-amine
PubChem CID55254144
Molecular FormulaC11H16FNO
Molecular Weight197.25 g/mol
Exact Mass197.12
IUPAC Name1-(2-ethoxy-5-fluorophenyl)propan-2-amine
SMILESCCOc1ccc(F)cc1CC(C)N
InChIInChI=1S/C11H16FNO/c1-3-14-11-5-4-10(12)7-9(11)6-8(2)13/h4-5,7-8H,3,6,13H2,1-2H3
InChIKeyRLGAVPQHXYOBTC-UHFFFAOYSA-N
XLogP2.11
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.25
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2-ethoxy-5-fluorophenyl)propan-2-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

1-(5-fluoro-2-propoxyphenyl)propan-2-amine
CID 103694484
1-[2-(2,5-difluorophenoxy)-5-fluorophenyl]propan-2-amine
CID 63803167
1-[5-fluoro-2-[2-(2-methylpropoxy)ethoxy]phenyl]propan-2-amine
CID 107700851
1-[2-[(2,6-dimethylphenyl)methoxy]-5-fluorophenyl]propan-2-amine
CID 107701121
1-(5-fluoro-2-pent-3-ynoxyphenyl)propan-2-amine
CID 107700673
1-(5-tert-butyl-2-ethoxyphenyl)propan-2-amine;hydrochloride
CID 170893780
1-[5-fluoro-2-[(4-methoxyphenyl)methoxy]phenyl]propan-2-amine
CID 107700785
1-[5-fluoro-2-[2-(trifluoromethylsulfanyl)ethoxy]phenyl]propan-2-amine
CID 107700941
2-[2-(2-aminopropyl)-4-fluorophenoxy]butanenitrile
CID 107700813
1-[2-[(E)-3-chloro-2-methylprop-2-enoxy]-5-fluorophenyl]propan-2-amine
CID 106439702
1-[2-(2-chlorophenoxy)-5-fluorophenyl]propan-2-amine
CID 63804291
1-[2-(3,4-difluorophenoxy)-5-fluorophenyl]propan-2-amine
CID 63802818

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxy-5-fluorophenyl)propan-2-amine?
The IUPAC name of 1-(2-ethoxy-5-fluorophenyl)propan-2-amine (CID 55254144) is 1-(2-ethoxy-5-fluorophenyl)propan-2-amine.
What is the SMILES notation for 1-(2-ethoxy-5-fluorophenyl)propan-2-amine?
The canonical SMILES for 1-(2-ethoxy-5-fluorophenyl)propan-2-amine is CCOc1ccc(F)cc1CC(C)N.
What is the InChIKey of 1-(2-ethoxy-5-fluorophenyl)propan-2-amine?
The InChIKey is RLGAVPQHXYOBTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNO/c1-3-14-11-5-4-10(12)7-9(11)6-8(2)13/h4-5,7-8H,3,6,13H2,1-2H3.
What are the key properties of 1-(2-ethoxy-5-fluorophenyl)propan-2-amine?
1-(2-ethoxy-5-fluorophenyl)propan-2-amine has a molecular weight of 197.25 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxy-5-fluorophenyl)propan-2-amine is sourced from PubChem (CID 55254144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).