azonin-2-one

C8H7NO — CID 74031286

IUPACazonin-2-one
SMILESO=C1C=CC=CC=C/C=N\1
InChIInChI=1S/C8H7NO/c10-8-6-4-2-1-3-5-7-9-8/h1-7H/b2-1?,5-3?,6-4?,9-7-
InChIKeyZYKIWZXIPQVWAB-NDGLXYIASA-N
MW133.15 g/mol
LogP1.27
Rot. Bonds

About azonin-2-one

azonin-2-one (PubChem CID 74031286) has the molecular formula C8H7NO and a molecular weight of 133.15 g/mol. Its IUPAC name is azonin-2-one.

Molecular Properties

Compound Nameazonin-2-one
PubChem CID74031286
Molecular FormulaC8H7NO
Molecular Weight133.15 g/mol
Exact Mass133.05
IUPAC Nameazonin-2-one
SMILESO=C1C=CC=CC=C/C=N\1
InChIInChI=1S/C8H7NO/c10-8-6-4-2-1-3-5-7-9-8/h1-7H/b2-1?,5-3?,6-4?,9-7-
InChIKeyZYKIWZXIPQVWAB-NDGLXYIASA-N
XLogP1.27
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of azonin-2-one?
The IUPAC name of azonin-2-one (CID 74031286) is azonin-2-one.
What is the SMILES notation for azonin-2-one?
The canonical SMILES for azonin-2-one is O=C1C=CC=CC=C/C=N\1.
What is the InChIKey of azonin-2-one?
The InChIKey is ZYKIWZXIPQVWAB-NDGLXYIASA-N. The full InChI is InChI=1S/C8H7NO/c10-8-6-4-2-1-3-5-7-9-8/h1-7H/b2-1?,5-3?,6-4?,9-7-.
What are the key properties of azonin-2-one?
azonin-2-one has a molecular weight of 133.15 g/mol, XLogP of 1.27, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azonin-2-one is sourced from PubChem (CID 74031286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).