7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one

C14H13NO2 — CID 54691173

IUPAC7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one
SMILESO=c1c(-c2ccccc2)c(O)cc2n1CCC2
InChIInChI=1S/C14H13NO2/c16-12-9-11-7-4-8-15(11)14(17)13(12)10-5-2-1-3-6-10/h1-3,5-6,9,16H,4,7-8H2
InChIKeyLMNBRQVWUBMBHO-UHFFFAOYSA-N
MW227.26 g/mol
LogP2.17
Rot. Bonds1

About 7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one

7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one (PubChem CID 54691173) has the molecular formula C14H13NO2 and a molecular weight of 227.26 g/mol. Its IUPAC name is 7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one.

Molecular Properties

Compound Name7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one
PubChem CID54691173
Molecular FormulaC14H13NO2
Molecular Weight227.26 g/mol
Exact Mass227.09
IUPAC Name7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one
SMILESO=c1c(-c2ccccc2)c(O)cc2n1CCC2
InChIInChI=1S/C14H13NO2/c16-12-9-11-7-4-8-15(11)14(17)13(12)10-5-2-1-3-6-10/h1-3,5-6,9,16H,4,7-8H2
InChIKeyLMNBRQVWUBMBHO-UHFFFAOYSA-N
XLogP2.17
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-4-hydroxy-6-methylpyridin-2(1H)-one
CID 54678659
3-Acetyl-1-benzyl-4-hydroxy-6-methylpyridin-2(1H)-one
CID 54677461
6-(cyclopentylmethyl)-4-hydroxy-3-phenyl-1H-pyridin-2-one
CID 76284490
4-Hydroxy-6-methyl-1-(2-phenylethyl)pyridin-2(1H)-one
CID 54694339
1-cyclopropyl-3-(4-fluorobenzyl)-4-hydroxy-2(1H)-pyridinone
CID 54676757
3-benzyl-1-cyclooctyl-4-hydroxy-2(1H)-pyridinone
CID 54687586
3-benzyl-4-hydroxy-1-(2-propynyl)-2(1H)-pyridinone
CID 54687585
1-benzyl-3-butyl-4-hydroxy-6-phenyl-2(1H)-pyridinone
CID 54693709
4-Hydroxy-6-isobutyl-1-methyl-3-phenyl-pyridin-2-one
CID 76280929
6-(cyclopropylmethyl)-4-hydroxy-3-phenyl-1H-pyridin-2-one
CID 76284488
4-hydroxy-6-isobutyl-3-phenyl-1H-pyridin-2-one
CID 76284760
4-hydroxy-6-methyl-3-phenylpyridin-2(1H)-one
CID 54708958

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one?
The IUPAC name of 7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one (CID 54691173) is 7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one.
What is the SMILES notation for 7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one?
The canonical SMILES for 7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one is O=c1c(-c2ccccc2)c(O)cc2n1CCC2.
What is the InChIKey of 7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one?
The InChIKey is LMNBRQVWUBMBHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2/c16-12-9-11-7-4-8-15(11)14(17)13(12)10-5-2-1-3-6-10/h1-3,5-6,9,16H,4,7-8H2.
What are the key properties of 7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one?
7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one has a molecular weight of 227.26 g/mol, XLogP of 2.17, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-6-phenyl-2,3-dihydro-1H-indolizin-5-one is sourced from PubChem (CID 54691173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).