2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine

C12H12FNO — CID 61078347

IUPAC2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine
SMILESNC(Cc1cccc(F)c1)c1ccoc1
InChIInChI=1S/C12H12FNO/c13-11-3-1-2-9(6-11)7-12(14)10-4-5-15-8-10/h1-6,8,12H,7,14H2
InChIKeyADQZKLPPWKGNJW-UHFFFAOYSA-N
MW205.23 g/mol
LogP2.66
Rot. Bonds3

About 2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine

2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine (PubChem CID 61078347) has the molecular formula C12H12FNO and a molecular weight of 205.23 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine
PubChem CID61078347
Molecular FormulaC12H12FNO
Molecular Weight205.23 g/mol
Exact Mass205.09
IUPAC Name2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine
SMILESNC(Cc1cccc(F)c1)c1ccoc1
InChIInChI=1S/C12H12FNO/c13-11-3-1-2-9(6-11)7-12(14)10-4-5-15-8-10/h1-6,8,12H,7,14H2
InChIKeyADQZKLPPWKGNJW-UHFFFAOYSA-N
XLogP2.66
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.23
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[1-bromo-2-(3-fluorophenyl)ethyl]furan
CID 63018725
2-(3-bromo-5-fluorophenyl)-1-(furan-3-yl)ethanamine
CID 79709295
2-(3-fluorophenyl)-1-phenylethanamine;hydrochloride
CID 25032833
1-(4-chlorophenyl)-2-(3-fluorophenyl)ethanamine
CID 43184847
2-(3-fluorophenyl)-1-(4-methylsulfanylphenyl)ethanamine
CID 79217792
1-(3-fluorophenyl)-2-phenylethanamine
CID 60818791
1-(5-bromothiophen-3-yl)-2-(3-fluorophenyl)ethanamine
CID 105095905
1-(3-fluorophenyl)-2-(3-methylphenyl)ethanamine
CID 54945902
1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine
CID 61079265
2-[(3-fluorophenyl)methyl]-3-(furan-3-yl)-N-methylpropan-1-amine
CID 83182297
2-(3-fluorophenyl)-1-(3-propan-2-yloxyphenyl)ethanamine
CID 62919131
N-ethyl-1-(3-fluorophenyl)-3-(furan-3-yl)propan-2-amine
CID 83175905

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine?
The IUPAC name of 2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine (CID 61078347) is 2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine.
What is the SMILES notation for 2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine?
The canonical SMILES for 2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine is NC(Cc1cccc(F)c1)c1ccoc1.
What is the InChIKey of 2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine?
The InChIKey is ADQZKLPPWKGNJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12FNO/c13-11-3-1-2-9(6-11)7-12(14)10-4-5-15-8-10/h1-6,8,12H,7,14H2.
What are the key properties of 2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine?
2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine has a molecular weight of 205.23 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-1-(furan-3-yl)ethanamine is sourced from PubChem (CID 61078347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).