5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine

C19H12N4O3 — CID 4972133

IUPAC5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine
SMILESc1coc(-c2oc3ncnc(Nc4ccncc4)c3c2-c2ccco2)c1
InChIInChI=1S/C19H12N4O3/c1-3-13(24-9-1)15-16-18(23-12-5-7-20-8-6-12)21-11-22-19(16)26-17(15)14-4-2-10-25-14/h1-11H,(H,20,21,22,23)
InChIKeyXDKGSFFAVWMPEU-UHFFFAOYSA-N
MW344.33 g/mol
LogP4.88
Rot. Bonds4

About 5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine

5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine (PubChem CID 4972133) has the molecular formula C19H12N4O3 and a molecular weight of 344.33 g/mol. Its IUPAC name is 5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine
PubChem CID4972133
Molecular FormulaC19H12N4O3
Molecular Weight344.33 g/mol
Exact Mass344.09
IUPAC Name5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine
SMILESc1coc(-c2oc3ncnc(Nc4ccncc4)c3c2-c2ccco2)c1
InChIInChI=1S/C19H12N4O3/c1-3-13(24-9-1)15-16-18(23-12-5-7-20-8-6-12)21-11-22-19(16)26-17(15)14-4-2-10-25-14/h1-11H,(H,20,21,22,23)
InChIKeyXDKGSFFAVWMPEU-UHFFFAOYSA-N
XLogP4.88
TPSA90.12 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.33
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine?
The IUPAC name of 5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine (CID 4972133) is 5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine is c1coc(-c2oc3ncnc(Nc4ccncc4)c3c2-c2ccco2)c1.
What is the InChIKey of 5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine?
The InChIKey is XDKGSFFAVWMPEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12N4O3/c1-3-13(24-9-1)15-16-18(23-12-5-7-20-8-6-12)21-11-22-19(16)26-17(15)14-4-2-10-25-14/h1-11H,(H,20,21,22,23).
What are the key properties of 5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine?
5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine has a molecular weight of 344.33 g/mol, XLogP of 4.88, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-bis(furan-2-yl)-N-pyridin-4-ylfuro[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 4972133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).