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

C9H10N2O3 — CID 105447864

IUPAC3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid
SMILESCc1nc(C(=O)O)c2n1CCC(=O)C2
InChIInChI=1S/C9H10N2O3/c1-5-10-8(9(13)14)7-4-6(12)2-3-11(5)7/h2-4H2,1H3,(H,13,14)
InChIKeyRDNKHBNZEURVNM-UHFFFAOYSA-N
MW194.19 g/mol
LogP0.41
Rot. Bonds1

About 3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid

3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid (PubChem CID 105447864) has the molecular formula C9H10N2O3 and a molecular weight of 194.19 g/mol. Its IUPAC name is 3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid.

Molecular Properties

Compound Name3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid
PubChem CID105447864
Molecular FormulaC9H10N2O3
Molecular Weight194.19 g/mol
Exact Mass194.07
IUPAC Name3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid
SMILESCc1nc(C(=O)O)c2n1CCC(=O)C2
InChIInChI=1S/C9H10N2O3/c1-5-10-8(9(13)14)7-4-6(12)2-3-11(5)7/h2-4H2,1H3,(H,13,14)
InChIKeyRDNKHBNZEURVNM-UHFFFAOYSA-N
XLogP0.41
TPSA72.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-bromo-3-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyridin-7-one
CID 83893540
7-butanoyl-3-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylic acid
CID 115267814
7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid
CID 105438527
1-methyl-3-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyridin-7-one
CID 83878156
1,2,5-trimethylimidazole-4-carboxylic acid
CID 82595358
2-hydroxy-2-(3-methyl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-1-yl)acetic acid
CID 82399811
2-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)propanoic acid
CID 83883838
3-methyl-2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyridin-7-one
CID 83892557
3-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyridin-7-one
CID 83872469
3-(3-oxobutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 116984242
N,3,7-trimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
CID 112552032
N'-hydroxy-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide
CID 83878925

Frequently Asked Questions

What is the IUPAC name of 3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid?
The IUPAC name of 3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid (CID 105447864) is 3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid.
What is the SMILES notation for 3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid?
The canonical SMILES for 3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid is Cc1nc(C(=O)O)c2n1CCC(=O)C2.
What is the InChIKey of 3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid?
The InChIKey is RDNKHBNZEURVNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O3/c1-5-10-8(9(13)14)7-4-6(12)2-3-11(5)7/h2-4H2,1H3,(H,13,14).
What are the key properties of 3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid?
3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid has a molecular weight of 194.19 g/mol, XLogP of 0.41, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyridine-1-carboxylic acid is sourced from PubChem (CID 105447864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).