3,5-dihydroimidazo[4,5-c]pyridin-6-one

C6H5N3O — CID 57313405

IUPAC3,5-dihydroimidazo[4,5-c]pyridin-6-one
SMILESO=c1cc2nc[nH]c2c[nH]1
InChIInChI=1S/C6H5N3O/c10-6-1-4-5(2-7-6)9-3-8-4/h1-3H,(H,7,10)(H,8,9)
InChIKeyOCCDWISPUBWEHC-UHFFFAOYSA-N
MW135.13 g/mol
LogP0.25
Rot. Bonds

About 3,5-dihydroimidazo[4,5-c]pyridin-6-one

3,5-dihydroimidazo[4,5-c]pyridin-6-one (PubChem CID 57313405) has the molecular formula C6H5N3O and a molecular weight of 135.13 g/mol. Its IUPAC name is 3,5-dihydroimidazo[4,5-c]pyridin-6-one.

Molecular Properties

Compound Name3,5-dihydroimidazo[4,5-c]pyridin-6-one
PubChem CID57313405
Molecular FormulaC6H5N3O
Molecular Weight135.13 g/mol
Exact Mass135.04
IUPAC Name3,5-dihydroimidazo[4,5-c]pyridin-6-one
SMILESO=c1cc2nc[nH]c2c[nH]1
InChIInChI=1S/C6H5N3O/c10-6-1-4-5(2-7-6)9-3-8-4/h1-3H,(H,7,10)(H,8,9)
InChIKeyOCCDWISPUBWEHC-UHFFFAOYSA-N
XLogP0.25
TPSA61.54 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.13
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dihydroimidazo[4,5-c]pyridin-6-one?
The IUPAC name of 3,5-dihydroimidazo[4,5-c]pyridin-6-one (CID 57313405) is 3,5-dihydroimidazo[4,5-c]pyridin-6-one.
What is the SMILES notation for 3,5-dihydroimidazo[4,5-c]pyridin-6-one?
The canonical SMILES for 3,5-dihydroimidazo[4,5-c]pyridin-6-one is O=c1cc2nc[nH]c2c[nH]1.
What is the InChIKey of 3,5-dihydroimidazo[4,5-c]pyridin-6-one?
The InChIKey is OCCDWISPUBWEHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3O/c10-6-1-4-5(2-7-6)9-3-8-4/h1-3H,(H,7,10)(H,8,9).
What are the key properties of 3,5-dihydroimidazo[4,5-c]pyridin-6-one?
3,5-dihydroimidazo[4,5-c]pyridin-6-one has a molecular weight of 135.13 g/mol, XLogP of 0.25, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dihydroimidazo[4,5-c]pyridin-6-one is sourced from PubChem (CID 57313405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).