5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine

C20H20N4O4 — CID 4894519

IUPAC5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine
SMILESc1coc(-c2oc3ncnc(NCCN4CCOCC4)c3c2-c2ccco2)c1
InChIInChI=1S/C20H20N4O4/c1-3-14(26-9-1)16-17-19(21-5-6-24-7-11-25-12-8-24)22-13-23-20(17)28-18(16)15-4-2-10-27-15/h1-4,9-10,13H,5-8,11-12H2,(H,21,22,23)
InChIKeyGAYRDXLKGVPWSA-UHFFFAOYSA-N
MW380.40 g/mol
LogP3.49
Rot. Bonds6

About 5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine

5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine (PubChem CID 4894519) has the molecular formula C20H20N4O4 and a molecular weight of 380.40 g/mol. Its IUPAC name is 5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine
PubChem CID4894519
Molecular FormulaC20H20N4O4
Molecular Weight380.40 g/mol
Exact Mass380.15
IUPAC Name5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine
SMILESc1coc(-c2oc3ncnc(NCCN4CCOCC4)c3c2-c2ccco2)c1
InChIInChI=1S/C20H20N4O4/c1-3-14(26-9-1)16-17-19(21-5-6-24-7-11-25-12-8-24)22-13-23-20(17)28-18(16)15-4-2-10-27-15/h1-4,9-10,13H,5-8,11-12H2,(H,21,22,23)
InChIKeyGAYRDXLKGVPWSA-UHFFFAOYSA-N
XLogP3.49
TPSA89.70 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.40
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine?
The IUPAC name of 5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine (CID 4894519) is 5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine is c1coc(-c2oc3ncnc(NCCN4CCOCC4)c3c2-c2ccco2)c1.
What is the InChIKey of 5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine?
The InChIKey is GAYRDXLKGVPWSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O4/c1-3-14(26-9-1)16-17-19(21-5-6-24-7-11-25-12-8-24)22-13-23-20(17)28-18(16)15-4-2-10-27-15/h1-4,9-10,13H,5-8,11-12H2,(H,21,22,23).
What are the key properties of 5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine?
5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine has a molecular weight of 380.40 g/mol, XLogP of 3.49, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 4894519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).