3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid

C11H16N2O2 — CID 83834119

IUPAC3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid
SMILESCCc1nc(C)c2n1CCCC2C(=O)O
InChIInChI=1S/C11H16N2O2/c1-3-9-12-7(2)10-8(11(14)15)5-4-6-13(9)10/h8H,3-6H2,1-2H3,(H,14,15)
InChIKeyLUNCIYPGRDKZHQ-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.72
Rot. Bonds2

About 3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid

3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid (PubChem CID 83834119) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid.

Molecular Properties

Compound Name3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid
PubChem CID83834119
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid
SMILESCCc1nc(C)c2n1CCCC2C(=O)O
InChIInChI=1S/C11H16N2O2/c1-3-9-12-7(2)10-8(11(14)15)5-4-6-13(9)10/h8H,3-6H2,1-2H3,(H,14,15)
InChIKeyLUNCIYPGRDKZHQ-UHFFFAOYSA-N
XLogP1.72
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

CID 82112079
CID 82112079
CID 82414298
CID 82414298
CID 82409146
CID 82409146
CID 84103163
CID 84103163
CID 84103164
CID 84103164
CID 84103171
CID 84103171
CID 84103172
CID 84103172
CID 112483316
CID 112483316
CID 166267910
CID 166267910
CID 75485649
CID 75485649
CID 19429293
CID 19429293
CID 19429294
CID 19429294

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid?
The IUPAC name of 3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid (CID 83834119) is 3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid.
What is the SMILES notation for 3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid?
The canonical SMILES for 3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid is CCc1nc(C)c2n1CCCC2C(=O)O.
What is the InChIKey of 3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid?
The InChIKey is LUNCIYPGRDKZHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-3-9-12-7(2)10-8(11(14)15)5-4-6-13(9)10/h8H,3-6H2,1-2H3,(H,14,15).
What are the key properties of 3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid?
3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid has a molecular weight of 208.26 g/mol, XLogP of 1.72, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid is sourced from PubChem (CID 83834119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).