1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid

C9H9N3O3 — CID 83883068

IUPAC1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid
SMILESCn1cc(C(=O)O)c2c(ncn2C)c1=O
InChIInChI=1S/C9H9N3O3/c1-11-3-5(9(14)15)7-6(8(11)13)10-4-12(7)2/h3-4H,1-2H3,(H,14,15)
InChIKeyUCQPSSFZPWYVNI-UHFFFAOYSA-N
MW207.19 g/mol
LogP-0.03
Rot. Bonds1

About 1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid

1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid (PubChem CID 83883068) has the molecular formula C9H9N3O3 and a molecular weight of 207.19 g/mol. Its IUPAC name is 1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid.

Molecular Properties

Compound Name1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid
PubChem CID83883068
Molecular FormulaC9H9N3O3
Molecular Weight207.19 g/mol
Exact Mass207.06
IUPAC Name1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid
SMILESCn1cc(C(=O)O)c2c(ncn2C)c1=O
InChIInChI=1S/C9H9N3O3/c1-11-3-5(9(14)15)7-6(8(11)13)10-4-12(7)2/h3-4H,1-2H3,(H,14,15)
InChIKeyUCQPSSFZPWYVNI-UHFFFAOYSA-N
XLogP-0.03
TPSA77.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.19
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid?
The IUPAC name of 1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid (CID 83883068) is 1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid.
What is the SMILES notation for 1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid?
The canonical SMILES for 1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid is Cn1cc(C(=O)O)c2c(ncn2C)c1=O.
What is the InChIKey of 1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid?
The InChIKey is UCQPSSFZPWYVNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O3/c1-11-3-5(9(14)15)7-6(8(11)13)10-4-12(7)2/h3-4H,1-2H3,(H,14,15).
What are the key properties of 1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid?
1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid has a molecular weight of 207.19 g/mol, XLogP of -0.03, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-4-oxoimidazo[4,5-c]pyridine-7-carboxylic acid is sourced from PubChem (CID 83883068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).