2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid

C17H14FN3O4 — CID 70659366

IUPAC2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid
SMILESO=C(O)c1cc2nc(-c3ccc(F)cc3)c(N3CCOCC3)nc2o1
InChIInChI=1S/C17H14FN3O4/c18-11-3-1-10(2-4-11)14-15(21-5-7-24-8-6-21)20-16-12(19-14)9-13(25-16)17(22)23/h1-4,9H,5-8H2,(H,22,23)
InChIKeyQLKVSEBVZLGPNF-UHFFFAOYSA-N
MW343.31 g/mol
LogP2.56
Rot. Bonds3

About 2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid

2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid (PubChem CID 70659366) has the molecular formula C17H14FN3O4 and a molecular weight of 343.31 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid.

Molecular Properties

Compound Name2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid
PubChem CID70659366
Molecular FormulaC17H14FN3O4
Molecular Weight343.31 g/mol
Exact Mass343.10
IUPAC Name2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid
SMILESO=C(O)c1cc2nc(-c3ccc(F)cc3)c(N3CCOCC3)nc2o1
InChIInChI=1S/C17H14FN3O4/c18-11-3-1-10(2-4-11)14-15(21-5-7-24-8-6-21)20-16-12(19-14)9-13(25-16)17(22)23/h1-4,9H,5-8H2,(H,22,23)
InChIKeyQLKVSEBVZLGPNF-UHFFFAOYSA-N
XLogP2.56
TPSA88.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.31
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid?
The IUPAC name of 2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid (CID 70659366) is 2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid.
What is the SMILES notation for 2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid?
The canonical SMILES for 2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid is O=C(O)c1cc2nc(-c3ccc(F)cc3)c(N3CCOCC3)nc2o1.
What is the InChIKey of 2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid?
The InChIKey is QLKVSEBVZLGPNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3O4/c18-11-3-1-10(2-4-11)14-15(21-5-7-24-8-6-21)20-16-12(19-14)9-13(25-16)17(22)23/h1-4,9H,5-8H2,(H,22,23).
What are the key properties of 2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid?
2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid has a molecular weight of 343.31 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-3-morpholin-4-ylfuro[2,3-b]pyrazine-6-carboxylic acid is sourced from PubChem (CID 70659366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).