7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione

C17H10FNO4 — CID 4859307

IUPAC7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
SMILESO=C1NC(c2ccc(O)cc2)c2c1oc1ccc(F)cc1c2=O
InChIInChI=1S/C17H10FNO4/c18-9-3-6-12-11(7-9)15(21)13-14(19-17(22)16(13)23-12)8-1-4-10(20)5-2-8/h1-7,14,20H,(H,19,22)
InChIKeyHYPANNIFNJAQAN-UHFFFAOYSA-N
MW311.27 g/mol
LogP2.47
Rot. Bonds1

About 7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione

7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione (PubChem CID 4859307) has the molecular formula C17H10FNO4 and a molecular weight of 311.27 g/mol. Its IUPAC name is 7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione.

Molecular Properties

Compound Name7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
PubChem CID4859307
Molecular FormulaC17H10FNO4
Molecular Weight311.27 g/mol
Exact Mass311.06
IUPAC Name7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
SMILESO=C1NC(c2ccc(O)cc2)c2c1oc1ccc(F)cc1c2=O
InChIInChI=1S/C17H10FNO4/c18-9-3-6-12-11(7-9)15(21)13-14(19-17(22)16(13)23-12)8-1-4-10(20)5-2-8/h1-7,14,20H,(H,19,22)
InChIKeyHYPANNIFNJAQAN-UHFFFAOYSA-N
XLogP2.47
TPSA79.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.27
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione?
The IUPAC name of 7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione (CID 4859307) is 7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione.
What is the SMILES notation for 7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione?
The canonical SMILES for 7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione is O=C1NC(c2ccc(O)cc2)c2c1oc1ccc(F)cc1c2=O.
What is the InChIKey of 7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione?
The InChIKey is HYPANNIFNJAQAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10FNO4/c18-9-3-6-12-11(7-9)15(21)13-14(19-17(22)16(13)23-12)8-1-4-10(20)5-2-8/h1-7,14,20H,(H,19,22).
What are the key properties of 7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione?
7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione has a molecular weight of 311.27 g/mol, XLogP of 2.47, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-1-(4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione is sourced from PubChem (CID 4859307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).