(1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine

C6H6BrF2NO — CID 130673890

IUPAC(1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine
SMILESN[C@H](c1ccc(Br)o1)C(F)F
InChIInChI=1S/C6H6BrF2NO/c7-4-2-1-3(11-4)5(10)6(8)9/h1-2,5-6H,10H2/t5-/m1/s1
InChIKeyCWHNNQTVSGIQHU-RXMQYKEDSA-N
MW226.02 g/mol
LogP2.31
Rot. Bonds2

About (1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine

(1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine (PubChem CID 130673890) has the molecular formula C6H6BrF2NO and a molecular weight of 226.02 g/mol. Its IUPAC name is (1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine.

Molecular Properties

Compound Name(1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine
PubChem CID130673890
Molecular FormulaC6H6BrF2NO
Molecular Weight226.02 g/mol
Exact Mass224.96
IUPAC Name(1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine
SMILESN[C@H](c1ccc(Br)o1)C(F)F
InChIInChI=1S/C6H6BrF2NO/c7-4-2-1-3(11-4)5(10)6(8)9/h1-2,5-6H,10H2/t5-/m1/s1
InChIKeyCWHNNQTVSGIQHU-RXMQYKEDSA-N
XLogP2.31
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.02
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(5-bromofuran-2-yl)-2-fluoroethanamine
CID 83820366
(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
2-amino-2-(5-bromofuran-2-yl)acetonitrile;hydrochloride
CID 14675973
1-(5-bromofuran-2-yl)-4-methoxy-2-methylbutan-1-amine
CID 105044594
(1S)-1-(5-bromofuran-2-yl)-4,4,4-trifluorobutan-1-amine;hydrochloride
CID 171219567
(R)-(5-bromofuran-2-yl)-cyclopropylmethanamine;hydrochloride
CID 171200042
(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
(3-bromo-2-fluorophenyl)-(5-bromofuran-2-yl)methanamine
CID 106648228
(5-bromofuran-2-yl)-(2,4-difluorophenyl)methanamine
CID 43464215

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine?
The IUPAC name of (1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine (CID 130673890) is (1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine.
What is the SMILES notation for (1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine?
The canonical SMILES for (1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine is N[C@H](c1ccc(Br)o1)C(F)F.
What is the InChIKey of (1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine?
The InChIKey is CWHNNQTVSGIQHU-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H6BrF2NO/c7-4-2-1-3(11-4)5(10)6(8)9/h1-2,5-6H,10H2/t5-/m1/s1.
What are the key properties of (1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine?
(1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine has a molecular weight of 226.02 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(5-bromofuran-2-yl)-2,2-difluoroethanamine is sourced from PubChem (CID 130673890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).