(5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine

C11H8BrClFNO — CID 105397394

IUPAC(5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine
SMILESNC(c1ccc(Br)o1)c1cc(F)ccc1Cl
InChIInChI=1S/C11H8BrClFNO/c12-10-4-3-9(16-10)11(15)7-5-6(14)1-2-8(7)13/h1-5,11H,15H2
InChIKeyULIFKQWRGSOYRY-UHFFFAOYSA-N
MW304.55 g/mol
LogP3.88
Rot. Bonds2

About (5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine

(5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine (PubChem CID 105397394) has the molecular formula C11H8BrClFNO and a molecular weight of 304.55 g/mol. Its IUPAC name is (5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine.

Molecular Properties

Compound Name(5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine
PubChem CID105397394
Molecular FormulaC11H8BrClFNO
Molecular Weight304.55 g/mol
Exact Mass302.95
IUPAC Name(5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine
SMILESNC(c1ccc(Br)o1)c1cc(F)ccc1Cl
InChIInChI=1S/C11H8BrClFNO/c12-10-4-3-9(16-10)11(15)7-5-6(14)1-2-8(7)13/h1-5,11H,15H2
InChIKeyULIFKQWRGSOYRY-UHFFFAOYSA-N
XLogP3.88
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.55
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine 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

(5-bromofuran-2-yl)-(2,4-difluorophenyl)methanamine
CID 43464215
(5-bromofuran-2-yl)-(4-chloro-3-fluorophenyl)methanamine
CID 107998826
1-(5-bromofuran-2-yl)-2-(2-chloro-5-fluorophenyl)ethanamine
CID 102622582
(2-chloro-5-fluorophenyl)-(2,4-difluorophenyl)methanamine
CID 105394907
(5-bromofuran-2-yl)-(2-chloro-4-methoxyphenyl)methanamine
CID 43561843
(2-chloro-5-fluorophenyl)-(4-chlorophenyl)methanamine
CID 105394650
(5-chlorofuran-2-yl)-(4-fluoro-2-methylphenyl)methanamine
CID 106691945
(2-bromo-5-methoxyphenyl)-(2-chloro-5-fluorophenyl)methanamine
CID 105396903
(5-bromofuran-2-yl)-(2-chloro-4,5-difluorophenyl)methanol
CID 107477162
(2-chloro-5-fluorophenyl)-(2,4-difluoro-5-methylphenyl)methanamine
CID 105397363
(2-chloro-4-fluorophenyl)-(2,5-dichlorophenyl)methanamine
CID 43344688
(2-bromo-4-fluorophenyl)-(5-ethylfuran-2-yl)methanamine
CID 62345677

Frequently Asked Questions

What is the IUPAC name of (5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine?
The IUPAC name of (5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine (CID 105397394) is (5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine.
What is the SMILES notation for (5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine?
The canonical SMILES for (5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine is NC(c1ccc(Br)o1)c1cc(F)ccc1Cl.
What is the InChIKey of (5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine?
The InChIKey is ULIFKQWRGSOYRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrClFNO/c12-10-4-3-9(16-10)11(15)7-5-6(14)1-2-8(7)13/h1-5,11H,15H2.
What are the key properties of (5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine?
(5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine has a molecular weight of 304.55 g/mol, XLogP of 3.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromofuran-2-yl)-(2-chloro-5-fluorophenyl)methanamine is sourced from PubChem (CID 105397394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).