4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione

C17H13NO4 — CID 54691182

IUPAC4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione
SMILESO=c1oc2cc3n(c(=O)c2c(O)c1-c1ccccc1)CCC3
InChIInChI=1S/C17H13NO4/c19-15-13(10-5-2-1-3-6-10)17(21)22-12-9-11-7-4-8-18(11)16(20)14(12)15/h1-3,5-6,9,19H,4,7-8H2
InChIKeyRTWXLTVZCUXSJX-UHFFFAOYSA-N
MW295.29 g/mol
LogP2.27
Rot. Bonds1

About 4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione

4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione (PubChem CID 54691182) has the molecular formula C17H13NO4 and a molecular weight of 295.29 g/mol. Its IUPAC name is 4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione.

Molecular Properties

Compound Name4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione
PubChem CID54691182
Molecular FormulaC17H13NO4
Molecular Weight295.29 g/mol
Exact Mass295.08
IUPAC Name4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione
SMILESO=c1oc2cc3n(c(=O)c2c(O)c1-c1ccccc1)CCC3
InChIInChI=1S/C17H13NO4/c19-15-13(10-5-2-1-3-6-10)17(21)22-12-9-11-7-4-8-18(11)16(20)14(12)15/h1-3,5-6,9,19H,4,7-8H2
InChIKeyRTWXLTVZCUXSJX-UHFFFAOYSA-N
XLogP2.27
TPSA72.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.29
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Ethyl 7-hydroxy-5-oxo-6-phenyl-1,2,3-trihydroindolizine-8-carboxylate
CID 54691175
Ethyl 7-hydroxy-5-oxo-6-benzyl-1,2,3-trihydroindolizine-8-carboxylate
CID 54691176
7-Hydroxy-5-oxo-6-benzyl-1,2,3-trihydroindolizine-8-carboxylic acid
CID 54691179
3-benzyl-4-hydroxy-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione
CID 54691181
5-benzyl-1-hydroxy-2-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione
CID 54691183
2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione
CID 54691184
6-cyclobutyl-4-ethyl-3-phenyl-8H-pyrano[3,2-c]pyridine-2,5,7-trione
CID 58317218
5-Methyl-3,7-diphenylfuro[2,3-f]indole-2,6-dione
CID 88741527
5-Hydroxy-14-(hydroxymethyl)-7-oxa-11-azapentacyclo[11.9.0.02,11.04,9.015,20]docosa-1(22),2,4(9),13,15,17,19,21-octaene-6,10-dione
CID 141989826
6-(12-Hydroxydodecyl)-3-phenylpyrano[3,2-c]pyridine-2,7-dione
CID 162356794
(6E)-6-benzylidene-4-ethyl-3,10-dioxo-1,4,7,8-tetrahydropyrano[3,4-f]indolizine-5-carboxylic acid
CID 9998918
3-Phenyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydrochromen-2-one
CID 13567630

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione?
The IUPAC name of 4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione (CID 54691182) is 4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione.
What is the SMILES notation for 4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione?
The canonical SMILES for 4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione is O=c1oc2cc3n(c(=O)c2c(O)c1-c1ccccc1)CCC3.
What is the InChIKey of 4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione?
The InChIKey is RTWXLTVZCUXSJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13NO4/c19-15-13(10-5-2-1-3-6-10)17(21)22-12-9-11-7-4-8-18(11)16(20)14(12)15/h1-3,5-6,9,19H,4,7-8H2.
What are the key properties of 4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione?
4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione has a molecular weight of 295.29 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione is sourced from PubChem (CID 54691182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).