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

C8H11N3O — CID 82414601

IUPAC8-(aminomethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
SMILESNCc1ccc(=O)n2c1NCC2
InChIInChI=1S/C8H11N3O/c9-5-6-1-2-7(12)11-4-3-10-8(6)11/h1-2,10H,3-5,9H2
InChIKeyLPJMVCAWNQCGEE-UHFFFAOYSA-N
MW165.20 g/mol
LogP-0.27
Rot. Bonds1

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

8-(aminomethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one (PubChem CID 82414601) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is 8-(aminomethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one.

Molecular Properties

Compound Name8-(aminomethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
PubChem CID82414601
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC Name8-(aminomethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
SMILESNCc1ccc(=O)n2c1NCC2
InChIInChI=1S/C8H11N3O/c9-5-6-1-2-7(12)11-4-3-10-8(6)11/h1-2,10H,3-5,9H2
InChIKeyLPJMVCAWNQCGEE-UHFFFAOYSA-N
XLogP-0.27
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-Dihydroimidazo[1,2-a]pyridin-5(1H)-one
CID 55263082
5-oxo-8-(trifluoromethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridine-3-carbonitrile
CID 15091360
1-[2-Oxo-2-(2-oxoimidazolidin-1-yl)ethyl]-5-(trifluoromethyl)pyridin-2-one
CID 16366299
8-(aminomethyl)-7-(trifluoromethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
CID 98771746
8-amino-7-(trifluoromethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
CID 98772517
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
7-methyl-5-oxo-2,3-dihydro-1H-imidazo[1,2-a]pyridine-8-carbonitrile
CID 84022015
6,7,8-trimethyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one
CID 12942155
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
1,4-Diazatricyclo[6.3.1.04,12]dodeca-6,8(12),9-triene-5,11-dione;dihydrochloride
CID 140551706

Frequently Asked Questions

What is the IUPAC name of 8-(aminomethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one?
The IUPAC name of 8-(aminomethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one (CID 82414601) is 8-(aminomethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one.
What is the SMILES notation for 8-(aminomethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one?
The canonical SMILES for 8-(aminomethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one is NCc1ccc(=O)n2c1NCC2.
What is the InChIKey of 8-(aminomethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one?
The InChIKey is LPJMVCAWNQCGEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c9-5-6-1-2-7(12)11-4-3-10-8(6)11/h1-2,10H,3-5,9H2.
What are the key properties of 8-(aminomethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one?
8-(aminomethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one has a molecular weight of 165.20 g/mol, XLogP of -0.27, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(aminomethyl)-2,3-dihydro-1H-imidazo[1,2-a]pyridin-5-one is sourced from PubChem (CID 82414601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).