3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one

C7H8N2O — CID 45087690

IUPAC3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one
SMILESO=C1CN2C=CC=CC2N1
InChIInChI=1S/C7H8N2O/c10-7-5-9-4-2-1-3-6(9)8-7/h1-4,6H,5H2,(H,8,10)
InChIKeyWVPREUZQBDTABK-UHFFFAOYSA-N
MW136.15 g/mol
LogP-0.17
Rot. Bonds

About 3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one

3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one (PubChem CID 45087690) has the molecular formula C7H8N2O and a molecular weight of 136.15 g/mol. Its IUPAC name is 3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one.

Molecular Properties

Compound Name3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one
PubChem CID45087690
Molecular FormulaC7H8N2O
Molecular Weight136.15 g/mol
Exact Mass136.06
IUPAC Name3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one
SMILESO=C1CN2C=CC=CC2N1
InChIInChI=1S/C7H8N2O/c10-7-5-9-4-2-1-3-6(9)8-7/h1-4,6H,5H2,(H,8,10)
InChIKeyWVPREUZQBDTABK-UHFFFAOYSA-N
XLogP-0.17
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.15
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one?
The IUPAC name of 3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one (CID 45087690) is 3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one.
What is the SMILES notation for 3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one?
The canonical SMILES for 3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one is O=C1CN2C=CC=CC2N1.
What is the InChIKey of 3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one?
The InChIKey is WVPREUZQBDTABK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O/c10-7-5-9-4-2-1-3-6(9)8-7/h1-4,6H,5H2,(H,8,10).
What are the key properties of 3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one?
3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one has a molecular weight of 136.15 g/mol, XLogP of -0.17, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8a-dihydro-1H-imidazo[1,2-a]pyridin-2-one is sourced from PubChem (CID 45087690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).