2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione

C24H19NO4 — CID 54691184

IUPAC2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione
SMILESO=c1oc2c(-c3ccccc3)c(=O)n3c(c2c(O)c1Cc1ccccc1)CCC3
InChIInChI=1S/C24H19NO4/c26-21-17(14-15-8-3-1-4-9-15)24(28)29-22-19(16-10-5-2-6-11-16)23(27)25-13-7-12-18(25)20(21)22/h1-6,8-11,26H,7,12-14H2
InChIKeyFSNALGITLODEBJ-UHFFFAOYSA-N
MW385.42 g/mol
LogP3.86
Rot. Bonds3

About 2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione

2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione (PubChem CID 54691184) has the molecular formula C24H19NO4 and a molecular weight of 385.42 g/mol. Its IUPAC name is 2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione.

Molecular Properties

Compound Name2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione
PubChem CID54691184
Molecular FormulaC24H19NO4
Molecular Weight385.42 g/mol
Exact Mass385.13
IUPAC Name2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione
SMILESO=c1oc2c(-c3ccccc3)c(=O)n3c(c2c(O)c1Cc1ccccc1)CCC3
InChIInChI=1S/C24H19NO4/c26-21-17(14-15-8-3-1-4-9-15)24(28)29-22-19(16-10-5-2-6-11-16)23(27)25-13-7-12-18(25)20(21)22/h1-6,8-11,26H,7,12-14H2
InChIKeyFSNALGITLODEBJ-UHFFFAOYSA-N
XLogP3.86
TPSA72.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione with MolForge

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Related Compounds

7-Hydroxy-6-benzyl-8-phenyl-1,2,3-trihydroindolizin-5-one
CID 54691171
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
3-benzyl-4-hydroxy-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione
CID 54691181
4-hydroxy-3-phenyl-8,9-dihydro-7H-pyrano[3,2-f]indolizine-2,5-dione
CID 54691182
5-benzyl-1-hydroxy-2-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione
CID 54691183
(9-acetyloxy-5-oxo-10-phenyl-2,3,5a,6-tetrahydro-1H-pyrrolo[1,2-b]isoquinolin-7-yl) acetate
CID 19868619
5-Acetyl-3,7-diphenylfuro[2,3-f]indole-2,6-dione
CID 86010332
5-Methyl-3,7-diphenylfuro[2,3-f]indole-2,6-dione
CID 88741527
6-(12-Hydroxydodecyl)-3-phenylpyrano[3,2-c]pyridine-2,7-dione
CID 162356794
3-Phenyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydrochromen-2-one
CID 13567630
Ethyl 4-hydroxy-1-methyl-2-oxo-3-phenyl-5,6,7,8-tetrahydroquinoline-8-carboxylate
CID 54705920

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione?
The IUPAC name of 2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione (CID 54691184) is 2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione.
What is the SMILES notation for 2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione?
The canonical SMILES for 2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione is O=c1oc2c(-c3ccccc3)c(=O)n3c(c2c(O)c1Cc1ccccc1)CCC3.
What is the InChIKey of 2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione?
The InChIKey is FSNALGITLODEBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO4/c26-21-17(14-15-8-3-1-4-9-15)24(28)29-22-19(16-10-5-2-6-11-16)23(27)25-13-7-12-18(25)20(21)22/h1-6,8-11,26H,7,12-14H2.
What are the key properties of 2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione?
2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione has a molecular weight of 385.42 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-1-hydroxy-5-phenyl-9,10-dihydro-8H-pyrano[2,3-g]indolizine-3,6-dione is sourced from PubChem (CID 54691184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).