7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid

C8H8N2O3 — CID 105438527

IUPAC7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid
SMILESO=C1CCn2cnc(C(=O)O)c2C1
InChIInChI=1S/C8H8N2O3/c11-5-1-2-10-4-9-7(8(12)13)6(10)3-5/h4H,1-3H2,(H,12,13)
InChIKeyXYCACNAFYSORPQ-UHFFFAOYSA-N
MW180.16 g/mol
LogP0.10
Rot. Bonds1

About 7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid

7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid (PubChem CID 105438527) has the molecular formula C8H8N2O3 and a molecular weight of 180.16 g/mol. Its IUPAC name is 7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid.

Molecular Properties

Compound Name7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid
PubChem CID105438527
Molecular FormulaC8H8N2O3
Molecular Weight180.16 g/mol
Exact Mass180.05
IUPAC Name7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid
SMILESO=C1CCn2cnc(C(=O)O)c2C1
InChIInChI=1S/C8H8N2O3/c11-5-1-2-10-4-9-7(8(12)13)6(10)3-5/h4H,1-3H2,(H,12,13)
InChIKeyXYCACNAFYSORPQ-UHFFFAOYSA-N
XLogP0.10
TPSA72.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.16
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6,7,8,9-tetrahydro-5H-imidazo[1,5-d][1,4]diazepine-1-carboxylic acid
CID 82408488
3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid
CID 105447864
7-(1,3-oxazol-2-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid
CID 96597290
7-(4-methylpentanoyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid
CID 115273264
7-(3-methylphenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid
CID 115003543
7-(1,2-oxazol-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid
CID 96597293
2,8-dioxo-1,5,7,11-tetrazatricyclo[7.3.0.03,7]dodeca-3,5,9,11-tetraene-4,10-dicarboxylic acid
CID 4281403
6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide
CID 170562180
6-(3-amino-2-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 170562199
1-chloro-7-hydroxy-6,8-dihydro-5H-imidazo[1,5-a]pyridine-7-carboxylic acid
CID 83887340
2-sulfanylidene-3,4-dihydro-1H-imidazo[1,5-a]pyrimidine-8-carboxamide
CID 10845548
1-(2,3-dihydro-1H-inden-5-yl)-6-methyl-4-oxopyridazine-3-carboxylic acid
CID 43154903

Frequently Asked Questions

What is the IUPAC name of 7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid?
The IUPAC name of 7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid (CID 105438527) is 7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid.
What is the SMILES notation for 7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid?
The canonical SMILES for 7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid is O=C1CCn2cnc(C(=O)O)c2C1.
What is the InChIKey of 7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid?
The InChIKey is XYCACNAFYSORPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O3/c11-5-1-2-10-4-9-7(8(12)13)6(10)3-5/h4H,1-3H2,(H,12,13).
What are the key properties of 7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid?
7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid has a molecular weight of 180.16 g/mol, XLogP of 0.10, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid is sourced from PubChem (CID 105438527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).