2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one

C13H17N3O — CID 117131280

IUPAC2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one
SMILESCN1CCC(c2cn3c(=O)cccc3[nH]2)CC1
InChIInChI=1S/C13H17N3O/c1-15-7-5-10(6-8-15)11-9-16-12(14-11)3-2-4-13(16)17/h2-4,9-10,14H,5-8H2,1H3
InChIKeyJPYPGWSLMGIAAJ-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.44
Rot. Bonds1

About 2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one

2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one (PubChem CID 117131280) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is 2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one.

Molecular Properties

Compound Name2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one
PubChem CID117131280
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC Name2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one
SMILESCN1CCC(c2cn3c(=O)cccc3[nH]2)CC1
InChIInChI=1S/C13H17N3O/c1-15-7-5-10(6-8-15)11-9-16-12(14-11)3-2-4-13(16)17/h2-4,9-10,14H,5-8H2,1H3
InChIKeyJPYPGWSLMGIAAJ-UHFFFAOYSA-N
XLogP1.44
TPSA40.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one?
The IUPAC name of 2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one (CID 117131280) is 2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one.
What is the SMILES notation for 2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one?
The canonical SMILES for 2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one is CN1CCC(c2cn3c(=O)cccc3[nH]2)CC1.
What is the InChIKey of 2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one?
The InChIKey is JPYPGWSLMGIAAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-15-7-5-10(6-8-15)11-9-16-12(14-11)3-2-4-13(16)17/h2-4,9-10,14H,5-8H2,1H3.
What are the key properties of 2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one?
2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one has a molecular weight of 231.30 g/mol, XLogP of 1.44, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpiperidin-4-yl)-1H-imidazo[1,2-a]pyridin-5-one is sourced from PubChem (CID 117131280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).