2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone

C9H9N3O — CID 83827412

IUPAC2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone
SMILESNCC(=O)c1ccn2cncc2c1
InChIInChI=1S/C9H9N3O/c10-4-9(13)7-1-2-12-6-11-5-8(12)3-7/h1-3,5-6H,4,10H2
InChIKeyUVTMYFQRAYGAJU-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.48
Rot. Bonds2

About 2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone

2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone (PubChem CID 83827412) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is 2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone.

Molecular Properties

Compound Name2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone
PubChem CID83827412
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC Name2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone
SMILESNCC(=O)c1ccn2cncc2c1
InChIInChI=1S/C9H9N3O/c10-4-9(13)7-1-2-12-6-11-5-8(12)3-7/h1-3,5-6H,4,10H2
InChIKeyUVTMYFQRAYGAJU-UHFFFAOYSA-N
XLogP0.48
TPSA60.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone?
The IUPAC name of 2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone (CID 83827412) is 2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone.
What is the SMILES notation for 2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone?
The canonical SMILES for 2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone is NCC(=O)c1ccn2cncc2c1.
What is the InChIKey of 2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone?
The InChIKey is UVTMYFQRAYGAJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c10-4-9(13)7-1-2-12-6-11-5-8(12)3-7/h1-3,5-6H,4,10H2.
What are the key properties of 2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone?
2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone has a molecular weight of 175.19 g/mol, XLogP of 0.48, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-imidazo[1,5-a]pyridin-7-ylethanone is sourced from PubChem (CID 83827412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).