2-fluoro-2-(2-propoxyphenyl)ethanamine

C11H16FNO — CID 104663546

IUPAC2-fluoro-2-(2-propoxyphenyl)ethanamine
SMILESCCCOc1ccccc1C(F)CN
InChIInChI=1S/C11H16FNO/c1-2-7-14-11-6-4-3-5-9(11)10(12)8-13/h3-6,10H,2,7-8,13H2,1H3
InChIKeyAXDVWLUARYUGCL-UHFFFAOYSA-N
MW197.25 g/mol
LogP2.44
Rot. Bonds5

About 2-fluoro-2-(2-propoxyphenyl)ethanamine

2-fluoro-2-(2-propoxyphenyl)ethanamine (PubChem CID 104663546) has the molecular formula C11H16FNO and a molecular weight of 197.25 g/mol. Its IUPAC name is 2-fluoro-2-(2-propoxyphenyl)ethanamine.

Molecular Properties

Compound Name2-fluoro-2-(2-propoxyphenyl)ethanamine
PubChem CID104663546
Molecular FormulaC11H16FNO
Molecular Weight197.25 g/mol
Exact Mass197.12
IUPAC Name2-fluoro-2-(2-propoxyphenyl)ethanamine
SMILESCCCOc1ccccc1C(F)CN
InChIInChI=1S/C11H16FNO/c1-2-7-14-11-6-4-3-5-9(11)10(12)8-13/h3-6,10H,2,7-8,13H2,1H3
InChIKeyAXDVWLUARYUGCL-UHFFFAOYSA-N
XLogP2.44
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.25
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-ethoxyphenyl)-2-fluoroethanamine
CID 112562684
2-(aminomethyl)-3-methyl-1-(2-propoxyphenyl)butan-1-ol
CID 107443118
(1R)-2-methyl-1-(2-propoxyphenyl)propan-1-amine;hydrochloride
CID 175653806
1-(2-propoxyphenyl)ethanol
CID 43503976
(1R)-2-amino-1-(2-butoxyphenyl)ethanol
CID 39242447
(1S)-2-amino-1-(2-butoxyphenyl)ethanol
CID 39242449
2-ethoxy-1-(2-propoxyphenyl)ethanamine
CID 104660329
1-(3-chlorobutan-2-yl)-2-propoxybenzene
CID 104662450
(2-ethylphenyl)-(2-propoxyphenyl)methanamine
CID 105035937
2-amino-1-(2-hexoxyphenyl)ethanol
CID 102543640
(1R)-2-amino-1-(2-hexoxyphenyl)ethanol
CID 124500421
2-(2-ethoxyphenyl)-2-fluoroethanol
CID 105425466

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-(2-propoxyphenyl)ethanamine?
The IUPAC name of 2-fluoro-2-(2-propoxyphenyl)ethanamine (CID 104663546) is 2-fluoro-2-(2-propoxyphenyl)ethanamine.
What is the SMILES notation for 2-fluoro-2-(2-propoxyphenyl)ethanamine?
The canonical SMILES for 2-fluoro-2-(2-propoxyphenyl)ethanamine is CCCOc1ccccc1C(F)CN.
What is the InChIKey of 2-fluoro-2-(2-propoxyphenyl)ethanamine?
The InChIKey is AXDVWLUARYUGCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNO/c1-2-7-14-11-6-4-3-5-9(11)10(12)8-13/h3-6,10H,2,7-8,13H2,1H3.
What are the key properties of 2-fluoro-2-(2-propoxyphenyl)ethanamine?
2-fluoro-2-(2-propoxyphenyl)ethanamine has a molecular weight of 197.25 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-(2-propoxyphenyl)ethanamine is sourced from PubChem (CID 104663546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).