1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine

C15H18FNO — CID 55061360

IUPAC1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine
SMILESCCc1ccc(C(Cc2ccccc2F)NC)o1
InChIInChI=1S/C15H18FNO/c1-3-12-8-9-15(18-12)14(17-2)10-11-6-4-5-7-13(11)16/h4-9,14,17H,3,10H2,1-2H3
InChIKeyZIPGAUMILQCNOB-UHFFFAOYSA-N
MW247.31 g/mol
LogP3.48
Rot. Bonds5

About 1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine

1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine (PubChem CID 55061360) has the molecular formula C15H18FNO and a molecular weight of 247.31 g/mol. Its IUPAC name is 1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine.

Molecular Properties

Compound Name1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine
PubChem CID55061360
Molecular FormulaC15H18FNO
Molecular Weight247.31 g/mol
Exact Mass247.14
IUPAC Name1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine
SMILESCCc1ccc(C(Cc2ccccc2F)NC)o1
InChIInChI=1S/C15H18FNO/c1-3-12-8-9-15(18-12)14(17-2)10-11-6-4-5-7-13(11)16/h4-9,14,17H,3,10H2,1-2H3
InChIKeyZIPGAUMILQCNOB-UHFFFAOYSA-N
XLogP3.48
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.31
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-ethylfuran-2-yl)-N,3-dimethylbutan-1-amine
CID 62346389
2-(2-fluorophenyl)-N-methyl-1-(2-methylphenyl)ethanamine
CID 55026735
2-(2-fluorophenyl)-N-methyl-1-(2,4,5-trifluorophenyl)ethanamine
CID 103302394
1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine
CID 105034717
1-(3,4-difluorophenyl)-2-(2-fluorophenyl)-N-methylethanamine
CID 43484603
[(5-ethylfuran-2-yl)-(2-fluorophenyl)methyl]hydrazine
CID 105292390
2-(2-fluorophenyl)-1-(3-fluorophenyl)-N-methylethanamine
CID 54945904
1-(5-chloro-2-fluorophenyl)-2-(2-fluorophenyl)-N-methylethanamine
CID 61066303
1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)-N-methylethanamine
CID 82814752
2-(2-fluorophenyl)-N-methyl-1-(2,4,6-trimethylphenyl)ethanamine
CID 43484269
1-(2,3-dihydrofuran-5-yl)-2-(2-fluorophenyl)-N-methylethanamine
CID 102651363
1-(5-ethylfuran-2-yl)-N-methyl-2-(2-propan-2-yl-1,2,4-triazol-3-yl)ethanamine
CID 104999769

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine?
The IUPAC name of 1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine (CID 55061360) is 1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine.
What is the SMILES notation for 1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine?
The canonical SMILES for 1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine is CCc1ccc(C(Cc2ccccc2F)NC)o1.
What is the InChIKey of 1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine?
The InChIKey is ZIPGAUMILQCNOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FNO/c1-3-12-8-9-15(18-12)14(17-2)10-11-6-4-5-7-13(11)16/h4-9,14,17H,3,10H2,1-2H3.
What are the key properties of 1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine?
1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine has a molecular weight of 247.31 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethylfuran-2-yl)-2-(2-fluorophenyl)-N-methylethanamine is sourced from PubChem (CID 55061360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).