(5-bromofuran-2-yl)-(4-fluorophenyl)methanamine

C11H9BrFNO — CID 43463931

IUPAC(5-bromofuran-2-yl)-(4-fluorophenyl)methanamine
SMILESNC(c1ccc(F)cc1)c1ccc(Br)o1
InChIInChI=1S/C11H9BrFNO/c12-10-6-5-9(15-10)11(14)7-1-3-8(13)4-2-7/h1-6,11H,14H2
InChIKeyWFAJWQZUZGNYJZ-UHFFFAOYSA-N
MW270.10 g/mol
LogP3.23
Rot. Bonds2

About (5-bromofuran-2-yl)-(4-fluorophenyl)methanamine

(5-bromofuran-2-yl)-(4-fluorophenyl)methanamine (PubChem CID 43463931) has the molecular formula C11H9BrFNO and a molecular weight of 270.10 g/mol. Its IUPAC name is (5-bromofuran-2-yl)-(4-fluorophenyl)methanamine.

Molecular Properties

Compound Name(5-bromofuran-2-yl)-(4-fluorophenyl)methanamine
PubChem CID43463931
Molecular FormulaC11H9BrFNO
Molecular Weight270.10 g/mol
Exact Mass268.99
IUPAC Name(5-bromofuran-2-yl)-(4-fluorophenyl)methanamine
SMILESNC(c1ccc(F)cc1)c1ccc(Br)o1
InChIInChI=1S/C11H9BrFNO/c12-10-6-5-9(15-10)11(14)7-1-3-8(13)4-2-7/h1-6,11H,14H2
InChIKeyWFAJWQZUZGNYJZ-UHFFFAOYSA-N
XLogP3.23
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.10
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5-bromofuran-2-yl)-(4-fluorophenyl)methanamine?
The IUPAC name of (5-bromofuran-2-yl)-(4-fluorophenyl)methanamine (CID 43463931) is (5-bromofuran-2-yl)-(4-fluorophenyl)methanamine.
What is the SMILES notation for (5-bromofuran-2-yl)-(4-fluorophenyl)methanamine?
The canonical SMILES for (5-bromofuran-2-yl)-(4-fluorophenyl)methanamine is NC(c1ccc(F)cc1)c1ccc(Br)o1.
What is the InChIKey of (5-bromofuran-2-yl)-(4-fluorophenyl)methanamine?
The InChIKey is WFAJWQZUZGNYJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrFNO/c12-10-6-5-9(15-10)11(14)7-1-3-8(13)4-2-7/h1-6,11H,14H2.
What are the key properties of (5-bromofuran-2-yl)-(4-fluorophenyl)methanamine?
(5-bromofuran-2-yl)-(4-fluorophenyl)methanamine has a molecular weight of 270.10 g/mol, XLogP of 3.23, 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)-(4-fluorophenyl)methanamine is sourced from PubChem (CID 43463931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).