2,3-dihydroimidazo[1,2-b]isoindol-5-one

C10H8N2O — CID 5002364

IUPAC2,3-dihydroimidazo[1,2-b]isoindol-5-one
SMILESO=C1c2ccccc2C2=NCCN12
InChIInChI=1S/C10H8N2O/c13-10-8-4-2-1-3-7(8)9-11-5-6-12(9)10/h1-4H,5-6H2
InChIKeyKBYGABSMKUYDEM-UHFFFAOYSA-N
MW172.19 g/mol
LogP0.90
Rot. Bonds

About 2,3-dihydroimidazo[1,2-b]isoindol-5-one

2,3-dihydroimidazo[1,2-b]isoindol-5-one (PubChem CID 5002364) has the molecular formula C10H8N2O and a molecular weight of 172.19 g/mol. Its IUPAC name is 2,3-dihydroimidazo[1,2-b]isoindol-5-one.

Molecular Properties

Compound Name2,3-dihydroimidazo[1,2-b]isoindol-5-one
PubChem CID5002364
Molecular FormulaC10H8N2O
Molecular Weight172.19 g/mol
Exact Mass172.06
IUPAC Name2,3-dihydroimidazo[1,2-b]isoindol-5-one
SMILESO=C1c2ccccc2C2=NCCN12
InChIInChI=1S/C10H8N2O/c13-10-8-4-2-1-3-7(8)9-11-5-6-12(9)10/h1-4H,5-6H2
InChIKeyKBYGABSMKUYDEM-UHFFFAOYSA-N
XLogP0.90
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.19
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroimidazo[1,2-b]isoindol-5-one?
The IUPAC name of 2,3-dihydroimidazo[1,2-b]isoindol-5-one (CID 5002364) is 2,3-dihydroimidazo[1,2-b]isoindol-5-one.
What is the SMILES notation for 2,3-dihydroimidazo[1,2-b]isoindol-5-one?
The canonical SMILES for 2,3-dihydroimidazo[1,2-b]isoindol-5-one is O=C1c2ccccc2C2=NCCN12.
What is the InChIKey of 2,3-dihydroimidazo[1,2-b]isoindol-5-one?
The InChIKey is KBYGABSMKUYDEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O/c13-10-8-4-2-1-3-7(8)9-11-5-6-12(9)10/h1-4H,5-6H2.
What are the key properties of 2,3-dihydroimidazo[1,2-b]isoindol-5-one?
2,3-dihydroimidazo[1,2-b]isoindol-5-one has a molecular weight of 172.19 g/mol, XLogP of 0.90, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroimidazo[1,2-b]isoindol-5-one is sourced from PubChem (CID 5002364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).