fluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate

C9H8FNO4 — CID 155238332

IUPACfluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate
SMILESO=C(OF)C1CCc2cc(O)cc(=O)n21
InChIInChI=1S/C9H8FNO4/c10-15-9(14)7-2-1-5-3-6(12)4-8(13)11(5)7/h3-4,7,12H,1-2H2
InChIKeyWINHQZYMQJZWJV-UHFFFAOYSA-N
MW213.16 g/mol
LogP0.47
Rot. Bonds1

About fluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate

fluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate (PubChem CID 155238332) has the molecular formula C9H8FNO4 and a molecular weight of 213.16 g/mol. Its IUPAC name is fluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate.

Molecular Properties

Compound Namefluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate
PubChem CID155238332
Molecular FormulaC9H8FNO4
Molecular Weight213.16 g/mol
Exact Mass213.04
IUPAC Namefluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate
SMILESO=C(OF)C1CCc2cc(O)cc(=O)n21
InChIInChI=1S/C9H8FNO4/c10-15-9(14)7-2-1-5-3-6(12)4-8(13)11(5)7/h3-4,7,12H,1-2H2
InChIKeyWINHQZYMQJZWJV-UHFFFAOYSA-N
XLogP0.47
TPSA68.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.16
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

A 58365A
CID 137365
(3S)-6-(2-carboxyethyl)-8-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylic acid
CID 11119038
5-oxo-7-(trifluoromethylsulfonyloxy)-2,3-dihydro-1H-indolizine-3-carboxylic acid
CID 126640439
(3S)-5-oxo-7-(trifluoromethylsulfonyloxy)-2,3-dihydro-1H-indolizine-3-carboxylic acid
CID 132015858
methyl (3S)-8-hydroxy-6-(3-methoxy-3-oxopropyl)-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate
CID 11000918
(3R)-6-(2-carboxyethyl)-8-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylic acid
CID 101945059
(S)-5-Oxo-1,2,3,5-tetrahydroindolizine-3-carboxylic acid
CID 57907462
methyl 8-hydroxy-6-(methylamino)-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate
CID 59975114
8-hydroxy-6-(methylamino)-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylic acid
CID 59975149
5-Oxo-1,2,3,5-tetrahydroindolizine-3-carboxylic acid
CID 76637873
7-Hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-3-carboxylic acid
CID 89650887
Ethyl 7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-3-carboxylate
CID 89651352

Frequently Asked Questions

What is the IUPAC name of fluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate?
The IUPAC name of fluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate (CID 155238332) is fluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate.
What is the SMILES notation for fluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate?
The canonical SMILES for fluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate is O=C(OF)C1CCc2cc(O)cc(=O)n21.
What is the InChIKey of fluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate?
The InChIKey is WINHQZYMQJZWJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FNO4/c10-15-9(14)7-2-1-5-3-6(12)4-8(13)11(5)7/h3-4,7,12H,1-2H2.
What are the key properties of fluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate?
fluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate has a molecular weight of 213.16 g/mol, XLogP of 0.47, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-3-carboxylate is sourced from PubChem (CID 155238332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).