2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide

C24H20N2O2 — CID 20592731

IUPAC2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide
SMILESCc1c(C(=O)C(N)=O)c2ccccn2c1Cc1ccccc1-c1ccccc1
InChIInChI=1S/C24H20N2O2/c1-16-21(26-14-8-7-13-20(26)22(16)23(27)24(25)28)15-18-11-5-6-12-19(18)17-9-3-2-4-10-17/h2-14H,15H2,1H3,(H2,25,28)
InChIKeyDYJRHQCLKIHDKZ-UHFFFAOYSA-N
MW368.44 g/mol
LogP4.17
Rot. Bonds5

About 2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide

2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide (PubChem CID 20592731) has the molecular formula C24H20N2O2 and a molecular weight of 368.44 g/mol. Its IUPAC name is 2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide.

Molecular Properties

Compound Name2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide
PubChem CID20592731
Molecular FormulaC24H20N2O2
Molecular Weight368.44 g/mol
Exact Mass368.15
IUPAC Name2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide
SMILESCc1c(C(=O)C(N)=O)c2ccccn2c1Cc1ccccc1-c1ccccc1
InChIInChI=1S/C24H20N2O2/c1-16-21(26-14-8-7-13-20(26)22(16)23(27)24(25)28)15-18-11-5-6-12-19(18)17-9-3-2-4-10-17/h2-14H,15H2,1H3,(H2,25,28)
InChIKeyDYJRHQCLKIHDKZ-UHFFFAOYSA-N
XLogP4.17
TPSA64.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.44
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide?
The IUPAC name of 2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide (CID 20592731) is 2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide.
What is the SMILES notation for 2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide?
The canonical SMILES for 2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide is Cc1c(C(=O)C(N)=O)c2ccccn2c1Cc1ccccc1-c1ccccc1.
What is the InChIKey of 2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide?
The InChIKey is DYJRHQCLKIHDKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O2/c1-16-21(26-14-8-7-13-20(26)22(16)23(27)24(25)28)15-18-11-5-6-12-19(18)17-9-3-2-4-10-17/h2-14H,15H2,1H3,(H2,25,28).
What are the key properties of 2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide?
2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide has a molecular weight of 368.44 g/mol, XLogP of 4.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methyl-3-[(2-phenylphenyl)methyl]indolizin-1-yl]-2-oxoacetamide is sourced from PubChem (CID 20592731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).