N-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide

C24H20N2O3 — CID 67106871

IUPACN-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide
SMILESCC(O)c1ccc(NC(=O)C(=O)c2c(-c3ccccc3)cc3ccccn23)cc1
InChIInChI=1S/C24H20N2O3/c1-16(27)17-10-12-19(13-11-17)25-24(29)23(28)22-21(18-7-3-2-4-8-18)15-20-9-5-6-14-26(20)22/h2-16,27H,1H3,(H,25,29)
InChIKeyQJYGVLIEMDURTN-UHFFFAOYSA-N
MW384.44 g/mol
LogP4.48
Rot. Bonds5

About N-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide

N-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide (PubChem CID 67106871) has the molecular formula C24H20N2O3 and a molecular weight of 384.44 g/mol. Its IUPAC name is N-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide.

Molecular Properties

Compound NameN-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide
PubChem CID67106871
Molecular FormulaC24H20N2O3
Molecular Weight384.44 g/mol
Exact Mass384.15
IUPAC NameN-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide
SMILESCC(O)c1ccc(NC(=O)C(=O)c2c(-c3ccccc3)cc3ccccn23)cc1
InChIInChI=1S/C24H20N2O3/c1-16(27)17-10-12-19(13-11-17)25-24(29)23(28)22-21(18-7-3-2-4-8-18)15-20-9-5-6-14-26(20)22/h2-16,27H,1H3,(H,25,29)
InChIKeyQJYGVLIEMDURTN-UHFFFAOYSA-N
XLogP4.48
TPSA70.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

4-[[2-oxo-2-(2-phenylindolizin-3-yl)acetyl]amino]-2-propan-2-ylbenzoic acid
CID 91265983
3-[[2-oxo-2-(2-phenylindolizin-3-yl)acetyl]amino]benzoic acid
CID 68828260
N-ethyl-2-oxo-2-(2-phenylindolizin-3-yl)acetamide
CID 2371420
[N-methyl-4-[[2-oxo-2-(2-phenylindolizin-3-yl)acetyl]amino]anilino] sulfite
CID 174605876
N-(1-methylbenzimidazol-5-yl)-2-oxo-2-(2-phenylindolizin-3-yl)acetamide
CID 67106521
N-[4-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide
CID 24997918
2-(2-propan-2-ylimidazol-1-yl)ethyl 2-methyl-2-[4-[[2-oxo-2-(2-phenylindolizin-3-yl)acetyl]amino]phenyl]propanoate
CID 24999782
N-[3-[2-(1-methyl-2-propan-2-ylimidazol-4-yl)propan-2-yl]phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide
CID 24998848
2-oxo-N-(2-oxo-1,3-dihydroindol-5-yl)-2-(2-phenylindolizin-3-yl)acetamide;[2-[[2-oxo-2-(2-phenylindolizin-3-yl)acetyl]amino]phenyl] N,N-diethylcarbamate
CID 160836079
1-(2-ethylpiperidin-1-yl)-2-(2-phenylindolizin-3-yl)ethane-1,2-dione
CID 54774341
N-[4-[4-(4,6-dimethyl-2-pyridinyl)piperazin-1-yl]-2-(methoxymethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide
CID 24998551
3-[[2-oxo-2-(2-phenylindolizin-3-yl)acetyl]amino]propyl 3,4-dichlorobenzoate
CID 2349365

Frequently Asked Questions

What is the IUPAC name of N-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide?
The IUPAC name of N-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide (CID 67106871) is N-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide.
What is the SMILES notation for N-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide?
The canonical SMILES for N-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide is CC(O)c1ccc(NC(=O)C(=O)c2c(-c3ccccc3)cc3ccccn23)cc1.
What is the InChIKey of N-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide?
The InChIKey is QJYGVLIEMDURTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O3/c1-16(27)17-10-12-19(13-11-17)25-24(29)23(28)22-21(18-7-3-2-4-8-18)15-20-9-5-6-14-26(20)22/h2-16,27H,1H3,(H,25,29).
What are the key properties of N-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide?
N-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide has a molecular weight of 384.44 g/mol, XLogP of 4.48, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1-hydroxyethyl)phenyl]-2-oxo-2-(2-phenylindolizin-3-yl)acetamide is sourced from PubChem (CID 67106871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).