1-(5-bromofuran-2-yl)-2-fluoroethanamine

C6H7BrFNO — CID 83820366

IUPAC1-(5-bromofuran-2-yl)-2-fluoroethanamine
SMILESNC(CF)c1ccc(Br)o1
InChIInChI=1S/C6H7BrFNO/c7-6-2-1-5(10-6)4(9)3-8/h1-2,4H,3,9H2
InChIKeyQWWWZUAKMNTHJL-UHFFFAOYSA-N
MW208.03 g/mol
LogP2.01
Rot. Bonds2

About 1-(5-bromofuran-2-yl)-2-fluoroethanamine

1-(5-bromofuran-2-yl)-2-fluoroethanamine (PubChem CID 83820366) has the molecular formula C6H7BrFNO and a molecular weight of 208.03 g/mol. Its IUPAC name is 1-(5-bromofuran-2-yl)-2-fluoroethanamine.

Molecular Properties

Compound Name1-(5-bromofuran-2-yl)-2-fluoroethanamine
PubChem CID83820366
Molecular FormulaC6H7BrFNO
Molecular Weight208.03 g/mol
Exact Mass206.97
IUPAC Name1-(5-bromofuran-2-yl)-2-fluoroethanamine
SMILESNC(CF)c1ccc(Br)o1
InChIInChI=1S/C6H7BrFNO/c7-6-2-1-5(10-6)4(9)3-8/h1-2,4H,3,9H2
InChIKeyQWWWZUAKMNTHJL-UHFFFAOYSA-N
XLogP2.01
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.03
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-(5-bromofuran-2-yl)-3-fluoropropan-1-amine;hydrochloride
CID 171219569
2-amino-2-(5-bromofuran-2-yl)ethanol
CID 82659275
(1S)-1-(5-bromofuran-2-yl)propane-1,3-diamine
CID 130817286
(1S)-1-(5-bromofuran-2-yl)-4,4,4-trifluorobutan-1-amine;hydrochloride
CID 171219567
(1R)-1-(5-bromofuran-2-yl)butan-1-amine;hydrochloride
CID 171200029
(1S)-1-(5-bromofuran-2-yl)-3-methylbutan-1-amine;hydrochloride
CID 171219563
(1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine
CID 130673890
3-amino-3-(5-bromofuran-2-yl)propanoic acid
CID 24706376
(1R)-1-(5-bromofuran-2-yl)pentan-1-amine
CID 146012743
(1S)-2-fluoro-1-(5-methylfuran-2-yl)ethanamine;hydrochloride
CID 171212357
1-(5-bromofuran-2-yl)-2-(5-ethylthiophen-2-yl)ethanamine
CID 115842605
1-(5-bromofuran-2-yl)-2-(2-chloro-5-fluorophenyl)ethanamine
CID 102622582

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromofuran-2-yl)-2-fluoroethanamine?
The IUPAC name of 1-(5-bromofuran-2-yl)-2-fluoroethanamine (CID 83820366) is 1-(5-bromofuran-2-yl)-2-fluoroethanamine.
What is the SMILES notation for 1-(5-bromofuran-2-yl)-2-fluoroethanamine?
The canonical SMILES for 1-(5-bromofuran-2-yl)-2-fluoroethanamine is NC(CF)c1ccc(Br)o1.
What is the InChIKey of 1-(5-bromofuran-2-yl)-2-fluoroethanamine?
The InChIKey is QWWWZUAKMNTHJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7BrFNO/c7-6-2-1-5(10-6)4(9)3-8/h1-2,4H,3,9H2.
What are the key properties of 1-(5-bromofuran-2-yl)-2-fluoroethanamine?
1-(5-bromofuran-2-yl)-2-fluoroethanamine has a molecular weight of 208.03 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromofuran-2-yl)-2-fluoroethanamine is sourced from PubChem (CID 83820366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).