2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine

C15H16FNO — CID 105410974

IUPAC2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine
SMILESCc1ccc(CCN)cc1Oc1ccccc1F
InChIInChI=1S/C15H16FNO/c1-11-6-7-12(8-9-17)10-15(11)18-14-5-3-2-4-13(14)16/h2-7,10H,8-9,17H2,1H3
InChIKeyDFNKXNMZUMQKDD-UHFFFAOYSA-N
MW245.30 g/mol
LogP3.43
Rot. Bonds4

About 2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine

2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine (PubChem CID 105410974) has the molecular formula C15H16FNO and a molecular weight of 245.30 g/mol. Its IUPAC name is 2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine.

Molecular Properties

Compound Name2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine
PubChem CID105410974
Molecular FormulaC15H16FNO
Molecular Weight245.30 g/mol
Exact Mass245.12
IUPAC Name2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine
SMILESCc1ccc(CCN)cc1Oc1ccccc1F
InChIInChI=1S/C15H16FNO/c1-11-6-7-12(8-9-17)10-15(11)18-14-5-3-2-4-13(14)16/h2-7,10H,8-9,17H2,1H3
InChIKeyDFNKXNMZUMQKDD-UHFFFAOYSA-N
XLogP3.43
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-(3-fluoro-4-methylphenoxy)-4-methylphenyl]ethanamine
CID 107171085
N-[[3-(2-fluorophenoxy)-4-methylphenyl]methyl]ethanamine
CID 105406669
2-(3-methoxy-4-methylphenyl)ethanamine
CID 13015320
2-[4-(2-ethoxyphenoxy)-3-fluorophenyl]ethanamine
CID 63817515
2-(4-fluoro-3-phenoxyphenyl)ethanamine
CID 170887829
[2-fluoro-4-(2-fluorophenoxy)-5-methylphenyl]methanamine;hydrochloride
CID 157181289
2-[2-(2-fluorophenoxy)phenyl]ethanamine
CID 63817709
2-[3-chloro-4-(5-chloro-2-methylphenoxy)phenyl]ethanamine
CID 81160082
2-[3-fluoro-4-(3-fluoro-4-methylphenoxy)phenyl]ethanamine
CID 107171074
[5-(2-aminoethyl)-2-methylphenoxy]methanetriamine
CID 163516444
2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine
CID 102990405
2-[3-(2-methylphenoxy)phenyl]ethanamine
CID 63942545

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine?
The IUPAC name of 2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine (CID 105410974) is 2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine.
What is the SMILES notation for 2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine?
The canonical SMILES for 2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine is Cc1ccc(CCN)cc1Oc1ccccc1F.
What is the InChIKey of 2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine?
The InChIKey is DFNKXNMZUMQKDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO/c1-11-6-7-12(8-9-17)10-15(11)18-14-5-3-2-4-13(14)16/h2-7,10H,8-9,17H2,1H3.
What are the key properties of 2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine?
2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine has a molecular weight of 245.30 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-fluorophenoxy)-4-methylphenyl]ethanamine is sourced from PubChem (CID 105410974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).