6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione

C7H8N2O2 — CID 13154365

IUPAC6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione
SMILESO=C1NC(=O)N2CCCC=C12
InChIInChI=1S/C7H8N2O2/c10-6-5-3-1-2-4-9(5)7(11)8-6/h3H,1-2,4H2,(H,8,10,11)
InChIKeyRRYMBFYMQVTYEA-UHFFFAOYSA-N
MW152.15 g/mol
LogP0.22
Rot. Bonds

About 6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione

6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione (PubChem CID 13154365) has the molecular formula C7H8N2O2 and a molecular weight of 152.15 g/mol. Its IUPAC name is 6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione.

Molecular Properties

Compound Name6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione
PubChem CID13154365
Molecular FormulaC7H8N2O2
Molecular Weight152.15 g/mol
Exact Mass152.06
IUPAC Name6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione
SMILESO=C1NC(=O)N2CCCC=C12
InChIInChI=1S/C7H8N2O2/c10-6-5-3-1-2-4-9(5)7(11)8-6/h3H,1-2,4H2,(H,8,10,11)
InChIKeyRRYMBFYMQVTYEA-UHFFFAOYSA-N
XLogP0.22
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione?
The IUPAC name of 6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione (CID 13154365) is 6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione.
What is the SMILES notation for 6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione?
The canonical SMILES for 6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione is O=C1NC(=O)N2CCCC=C12.
What is the InChIKey of 6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione?
The InChIKey is RRYMBFYMQVTYEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2/c10-6-5-3-1-2-4-9(5)7(11)8-6/h3H,1-2,4H2,(H,8,10,11).
What are the key properties of 6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione?
6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione has a molecular weight of 152.15 g/mol, XLogP of 0.22, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-5H-imidazo[1,5-a]pyridine-1,3-dione is sourced from PubChem (CID 13154365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).