8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one

C9H13N3O — CID 98684753

IUPAC8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
SMILESCCc1cc(=O)n2c(c1N)NCC2
InChIInChI=1S/C9H13N3O/c1-2-6-5-7(13)12-4-3-11-9(12)8(6)10/h5,11H,2-4,10H2,1H3
InChIKeyAYWAJFDBDWXONT-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.42
Rot. Bonds1

About 8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one

8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one (PubChem CID 98684753) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one.

Molecular Properties

Compound Name8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
PubChem CID98684753
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
SMILESCCc1cc(=O)n2c(c1N)NCC2
InChIInChI=1S/C9H13N3O/c1-2-6-5-7(13)12-4-3-11-9(12)8(6)10/h5,11H,2-4,10H2,1H3
InChIKeyAYWAJFDBDWXONT-UHFFFAOYSA-N
XLogP0.42
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one?
The IUPAC name of 8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one (CID 98684753) is 8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one.
What is the SMILES notation for 8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one?
The canonical SMILES for 8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one is CCc1cc(=O)n2c(c1N)NCC2.
What is the InChIKey of 8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one?
The InChIKey is AYWAJFDBDWXONT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-2-6-5-7(13)12-4-3-11-9(12)8(6)10/h5,11H,2-4,10H2,1H3.
What are the key properties of 8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one?
8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one has a molecular weight of 179.22 g/mol, XLogP of 0.42, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-amino-7-ethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one is sourced from PubChem (CID 98684753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).