ethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide

C19H20N2O3 — CID 91113408

IUPACethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide
SMILESCC.NC(=O)CN1C(=O)C2(COc3ccccc32)c2ccccc21
InChIInChI=1S/C17H14N2O3.C2H6/c18-15(20)9-19-13-7-3-1-5-11(13)17(16(19)21)10-22-14-8-4-2-6-12(14)17;1-2/h1-8H,9-10H2,(H2,18,20);1-2H3
InChIKeyZLVKKPGRWYMDSZ-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.22
Rot. Bonds2

About ethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide

ethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide (PubChem CID 91113408) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is ethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide.

Molecular Properties

Compound Nameethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide
PubChem CID91113408
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Nameethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide
SMILESCC.NC(=O)CN1C(=O)C2(COc3ccccc32)c2ccccc21
InChIInChI=1S/C17H14N2O3.C2H6/c18-15(20)9-19-13-7-3-1-5-11(13)17(16(19)21)10-22-14-8-4-2-6-12(14)17;1-2/h1-8H,9-10H2,(H2,18,20);1-2H3
InChIKeyZLVKKPGRWYMDSZ-UHFFFAOYSA-N
XLogP2.22
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide?
The IUPAC name of ethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide (CID 91113408) is ethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide.
What is the SMILES notation for ethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide?
The canonical SMILES for ethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide is CC.NC(=O)CN1C(=O)C2(COc3ccccc32)c2ccccc21.
What is the InChIKey of ethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide?
The InChIKey is ZLVKKPGRWYMDSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O3.C2H6/c18-15(20)9-19-13-7-3-1-5-11(13)17(16(19)21)10-22-14-8-4-2-6-12(14)17;1-2/h1-8H,9-10H2,(H2,18,20);1-2H3.
What are the key properties of ethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide?
ethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide has a molecular weight of 324.38 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(2'-oxospiro[2H-1-benzofuran-3,3'-indole]-1'-yl)acetamide is sourced from PubChem (CID 91113408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).