4-bromo-5-morpholin-4-ylfuran-2-amine

C8H11BrN2O2 — CID 98770124

IUPAC4-bromo-5-morpholin-4-ylfuran-2-amine
SMILESNc1cc(Br)c(N2CCOCC2)o1
InChIInChI=1S/C8H11BrN2O2/c9-6-5-7(10)13-8(6)11-1-3-12-4-2-11/h5H,1-4,10H2
InChIKeyVLAWLCAFUZMDNP-UHFFFAOYSA-N
MW247.09 g/mol
LogP1.46
Rot. Bonds1

About 4-bromo-5-morpholin-4-ylfuran-2-amine

4-bromo-5-morpholin-4-ylfuran-2-amine (PubChem CID 98770124) has the molecular formula C8H11BrN2O2 and a molecular weight of 247.09 g/mol. Its IUPAC name is 4-bromo-5-morpholin-4-ylfuran-2-amine.

Molecular Properties

Compound Name4-bromo-5-morpholin-4-ylfuran-2-amine
PubChem CID98770124
Molecular FormulaC8H11BrN2O2
Molecular Weight247.09 g/mol
Exact Mass246.00
IUPAC Name4-bromo-5-morpholin-4-ylfuran-2-amine
SMILESNc1cc(Br)c(N2CCOCC2)o1
InChIInChI=1S/C8H11BrN2O2/c9-6-5-7(10)13-8(6)11-1-3-12-4-2-11/h5H,1-4,10H2
InChIKeyVLAWLCAFUZMDNP-UHFFFAOYSA-N
XLogP1.46
TPSA51.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.09
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-5-morpholin-4-ylfuran-2-amine?
The IUPAC name of 4-bromo-5-morpholin-4-ylfuran-2-amine (CID 98770124) is 4-bromo-5-morpholin-4-ylfuran-2-amine.
What is the SMILES notation for 4-bromo-5-morpholin-4-ylfuran-2-amine?
The canonical SMILES for 4-bromo-5-morpholin-4-ylfuran-2-amine is Nc1cc(Br)c(N2CCOCC2)o1.
What is the InChIKey of 4-bromo-5-morpholin-4-ylfuran-2-amine?
The InChIKey is VLAWLCAFUZMDNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11BrN2O2/c9-6-5-7(10)13-8(6)11-1-3-12-4-2-11/h5H,1-4,10H2.
What are the key properties of 4-bromo-5-morpholin-4-ylfuran-2-amine?
4-bromo-5-morpholin-4-ylfuran-2-amine has a molecular weight of 247.09 g/mol, XLogP of 1.46, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-5-morpholin-4-ylfuran-2-amine is sourced from PubChem (CID 98770124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).