6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine

C9H5BrCl2N2O — CID 102753401

IUPAC6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine
SMILESNc1nc(-c2occc2Br)c(Cl)cc1Cl
InChIInChI=1S/C9H5BrCl2N2O/c10-4-1-2-15-8(4)7-5(11)3-6(12)9(13)14-7/h1-3H,(H2,13,14)
InChIKeyULOIOEOFIVRVQM-UHFFFAOYSA-N
MW307.96 g/mol
LogP3.99
Rot. Bonds1

About 6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine

6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine (PubChem CID 102753401) has the molecular formula C9H5BrCl2N2O and a molecular weight of 307.96 g/mol. Its IUPAC name is 6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine.

Molecular Properties

Compound Name6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine
PubChem CID102753401
Molecular FormulaC9H5BrCl2N2O
Molecular Weight307.96 g/mol
Exact Mass305.90
IUPAC Name6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine
SMILESNc1nc(-c2occc2Br)c(Cl)cc1Cl
InChIInChI=1S/C9H5BrCl2N2O/c10-4-1-2-15-8(4)7-5(11)3-6(12)9(13)14-7/h1-3H,(H2,13,14)
InChIKeyULOIOEOFIVRVQM-UHFFFAOYSA-N
XLogP3.99
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.96
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine?
The IUPAC name of 6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine (CID 102753401) is 6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine.
What is the SMILES notation for 6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine?
The canonical SMILES for 6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine is Nc1nc(-c2occc2Br)c(Cl)cc1Cl.
What is the InChIKey of 6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine?
The InChIKey is ULOIOEOFIVRVQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5BrCl2N2O/c10-4-1-2-15-8(4)7-5(11)3-6(12)9(13)14-7/h1-3H,(H2,13,14).
What are the key properties of 6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine?
6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine has a molecular weight of 307.96 g/mol, XLogP of 3.99, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-bromofuran-2-yl)-3,5-dichloropyridin-2-amine is sourced from PubChem (CID 102753401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).