8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one

C9H13N3O — CID 98684756

IUPAC8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
SMILESNCCc1ccc(=O)n2c1NCC2
InChIInChI=1S/C9H13N3O/c10-4-3-7-1-2-8(13)12-6-5-11-9(7)12/h1-2,11H,3-6,10H2
InChIKeyGMAGJZAHMIYIJO-UHFFFAOYSA-N
MW179.22 g/mol
LogP-0.22
Rot. Bonds2

About 8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one

8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one (PubChem CID 98684756) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one.

Molecular Properties

Compound Name8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
PubChem CID98684756
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
SMILESNCCc1ccc(=O)n2c1NCC2
InChIInChI=1S/C9H13N3O/c10-4-3-7-1-2-8(13)12-6-5-11-9(7)12/h1-2,11H,3-6,10H2
InChIKeyGMAGJZAHMIYIJO-UHFFFAOYSA-N
XLogP-0.22
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1,2,3,7-Tetrahydro-6H-pyrrolo[2,3-b]pyridin-6-one
CID 55288522
8-(1-Aminoethyl)-1-methyl-7-(trifluoromethyl)-2,3-dihydroimidazo[1,2-a]pyridin-5-one
CID 82623915
8-(3-aminopropyl)-7-(trifluoromethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
CID 82623916
8-(2-Aminoethyl)-1-methyl-7-(trifluoromethyl)-2,3-dihydroimidazo[1,2-a]pyridin-5-one
CID 82623917
8-(aminomethyl)-7-(trifluoromethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
CID 98771746
8-(2,2,2-Trifluoroacetyl)-2,3-dihydroimidazo[1,2-a]pyridin-5(1H)-one
CID 102534381
7-methyl-8-prop-2-enyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
CID 10559582
6,7,8-trimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
CID 12942155
(2R,3S)-2,3-di(phenyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one;tris(yttrium)
CID 57973955
1,4-Diazatricyclo[6.3.1.04,12]dodeca-6,8(12),9-triene-5,11-dione
CID 67030452
1,2,3,5-Tetrahydroimidazo[1,2-a]pyridine-8-carboxamide
CID 139706457
2,3-di(phenyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one;bis(yttrium)
CID 145493134

Frequently Asked Questions

What is the IUPAC name of 8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one?
The IUPAC name of 8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one (CID 98684756) is 8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one.
What is the SMILES notation for 8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one?
The canonical SMILES for 8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one is NCCc1ccc(=O)n2c1NCC2.
What is the InChIKey of 8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one?
The InChIKey is GMAGJZAHMIYIJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c10-4-3-7-1-2-8(13)12-6-5-11-9(7)12/h1-2,11H,3-6,10H2.
What are the key properties of 8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one?
8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one has a molecular weight of 179.22 g/mol, XLogP of -0.22, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-aminoethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one is sourced from PubChem (CID 98684756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).