N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide

C21H18N4O4 — CID 1072900

IUPACN-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide
SMILESO=C(Nc1ccc2nc(-c3ccco3)c(-c3ccco3)nc2c1)N1CCOCC1
InChIInChI=1S/C21H18N4O4/c26-21(25-7-11-27-12-8-25)22-14-5-6-15-16(13-14)24-20(18-4-2-10-29-18)19(23-15)17-3-1-9-28-17/h1-6,9-10,13H,7-8,11-12H2,(H,22,26)
InChIKeyDFTFDBZTSJXMRZ-UHFFFAOYSA-N
MW390.40 g/mol
LogP4.01
Rot. Bonds3

About N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide

N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide (PubChem CID 1072900) has the molecular formula C21H18N4O4 and a molecular weight of 390.40 g/mol. Its IUPAC name is N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide
PubChem CID1072900
Molecular FormulaC21H18N4O4
Molecular Weight390.40 g/mol
Exact Mass390.13
IUPAC NameN-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide
SMILESO=C(Nc1ccc2nc(-c3ccco3)c(-c3ccco3)nc2c1)N1CCOCC1
InChIInChI=1S/C21H18N4O4/c26-21(25-7-11-27-12-8-25)22-14-5-6-15-16(13-14)24-20(18-4-2-10-29-18)19(23-15)17-3-1-9-28-17/h1-6,9-10,13H,7-8,11-12H2,(H,22,26)
InChIKeyDFTFDBZTSJXMRZ-UHFFFAOYSA-N
XLogP4.01
TPSA93.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.40
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide?
The IUPAC name of N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide (CID 1072900) is N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide.
What is the SMILES notation for N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide?
The canonical SMILES for N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide is O=C(Nc1ccc2nc(-c3ccco3)c(-c3ccco3)nc2c1)N1CCOCC1.
What is the InChIKey of N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide?
The InChIKey is DFTFDBZTSJXMRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O4/c26-21(25-7-11-27-12-8-25)22-14-5-6-15-16(13-14)24-20(18-4-2-10-29-18)19(23-15)17-3-1-9-28-17/h1-6,9-10,13H,7-8,11-12H2,(H,22,26).
What are the key properties of N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide?
N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide has a molecular weight of 390.40 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,3-bis(furan-2-yl)quinoxalin-6-yl]morpholine-4-carboxamide is sourced from PubChem (CID 1072900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).