1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one

C19H11F2NO4S — CID 108655634

IUPAC1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
SMILESO=C(C1=C(O)C(=O)N(c2ccc(F)cc2F)C1c1ccco1)c1cccs1
InChIInChI=1S/C19H11F2NO4S/c20-10-5-6-12(11(21)9-10)22-16(13-3-1-7-26-13)15(18(24)19(22)25)17(23)14-4-2-8-27-14/h1-9,16,24H
InChIKeyGJLFQOHHIHWODU-UHFFFAOYSA-N
MW387.36 g/mol
LogP4.40
Rot. Bonds4

About 1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one

1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one (PubChem CID 108655634) has the molecular formula C19H11F2NO4S and a molecular weight of 387.36 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
PubChem CID108655634
Molecular FormulaC19H11F2NO4S
Molecular Weight387.36 g/mol
Exact Mass387.04
IUPAC Name1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
SMILESO=C(C1=C(O)C(=O)N(c2ccc(F)cc2F)C1c1ccco1)c1cccs1
InChIInChI=1S/C19H11F2NO4S/c20-10-5-6-12(11(21)9-10)22-16(13-3-1-7-26-13)15(18(24)19(22)25)17(23)14-4-2-8-27-14/h1-9,16,24H
InChIKeyGJLFQOHHIHWODU-UHFFFAOYSA-N
XLogP4.40
TPSA70.75 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.36
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2,4-difluorophenyl)-4-hydroxy-2-pyridin-4-yl-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
CID 108633973
2-(furan-2-yl)-4-hydroxy-1-(4-propan-2-ylphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
CID 108653199
1-(2,5-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-propanoyl-2H-pyrrol-5-one
CID 108655776
1-(2,4-difluorophenyl)-3-(2,2-dimethylpropanoyl)-4-hydroxy-2-thiophen-2-yl-2H-pyrrol-5-one
CID 108588246
1-(4-fluorophenyl)-4-hydroxy-2-(4-hydroxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
CID 108616422
1-(2,4-difluorophenyl)-4-hydroxy-3-(2-methylpropanoyl)-2-thiophen-2-yl-2H-pyrrol-5-one
CID 108588247
2-[2-(furan-2-yl)-4-hydroxy-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]ethyl-dimethylazanium
CID 5081639
4-[[2-(furan-2-yl)-4-hydroxy-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]methyl]benzoic acid
CID 108607381
1-[3-(dimethylamino)propyl]-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
CID 2910001
1-(2,4-difluorophenyl)-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2-thiophen-2-yl-2H-pyrrol-5-one
CID 108588267
1-(4-fluorophenyl)-4-hydroxy-2-(3-methylphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
CID 108618583
1-(2,5-difluorophenyl)-3-(furan-2-carbonyl)-4-hydroxy-2-pyridin-4-yl-2H-pyrrol-5-one
CID 108634119

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one?
The IUPAC name of 1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one (CID 108655634) is 1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one.
What is the SMILES notation for 1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one?
The canonical SMILES for 1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one is O=C(C1=C(O)C(=O)N(c2ccc(F)cc2F)C1c1ccco1)c1cccs1.
What is the InChIKey of 1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one?
The InChIKey is GJLFQOHHIHWODU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11F2NO4S/c20-10-5-6-12(11(21)9-10)22-16(13-3-1-7-26-13)15(18(24)19(22)25)17(23)14-4-2-8-27-14/h1-9,16,24H.
What are the key properties of 1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one?
1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one has a molecular weight of 387.36 g/mol, XLogP of 4.40, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one is sourced from PubChem (CID 108655634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).