spiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione

C15H11N3O2 — CID 2922157

IUPACspiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione
SMILESO=C1NC2(Nc3ccccc31)C(=O)Nc1ccccc12
InChIInChI=1S/C15H11N3O2/c19-13-9-5-1-3-7-11(9)17-15(18-13)10-6-2-4-8-12(10)16-14(15)20/h1-8,17H,(H,16,20)(H,18,19)
InChIKeyBMSQIJFIMYFICP-UHFFFAOYSA-N
MW265.27 g/mol
LogP1.65
Rot. Bonds

About spiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione

spiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione (PubChem CID 2922157) has the molecular formula C15H11N3O2 and a molecular weight of 265.27 g/mol. Its IUPAC name is spiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione.

Molecular Properties

Compound Namespiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione
PubChem CID2922157
Molecular FormulaC15H11N3O2
Molecular Weight265.27 g/mol
Exact Mass265.09
IUPAC Namespiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione
SMILESO=C1NC2(Nc3ccccc31)C(=O)Nc1ccccc12
InChIInChI=1S/C15H11N3O2/c19-13-9-5-1-3-7-11(9)17-15(18-13)10-6-2-4-8-12(10)16-14(15)20/h1-8,17H,(H,16,20)(H,18,19)
InChIKeyBMSQIJFIMYFICP-UHFFFAOYSA-N
XLogP1.65
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 51.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of spiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione?
The IUPAC name of spiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione (CID 2922157) is spiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione.
What is the SMILES notation for spiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione?
The canonical SMILES for spiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione is O=C1NC2(Nc3ccccc31)C(=O)Nc1ccccc12.
What is the InChIKey of spiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione?
The InChIKey is BMSQIJFIMYFICP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O2/c19-13-9-5-1-3-7-11(9)17-15(18-13)10-6-2-4-8-12(10)16-14(15)20/h1-8,17H,(H,16,20)(H,18,19).
What are the key properties of spiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione?
spiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione has a molecular weight of 265.27 g/mol, XLogP of 1.65, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,3-dihydroquinazoline-2,3'-1H-indole]-2',4-dione is sourced from PubChem (CID 2922157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).