1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid

C14H8Cl2N2O2 — CID 117251414

IUPAC1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid
SMILESO=C(O)c1ccc2c(Cl)nc(-c3ccc(Cl)cc3)n2c1
InChIInChI=1S/C14H8Cl2N2O2/c15-10-4-1-8(2-5-10)13-17-12(16)11-6-3-9(14(19)20)7-18(11)13/h1-7H,(H,19,20)
InChIKeyDJEMUSJUELFYOW-UHFFFAOYSA-N
MW307.14 g/mol
LogP4.01
Rot. Bonds2

About 1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid

1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid (PubChem CID 117251414) has the molecular formula C14H8Cl2N2O2 and a molecular weight of 307.14 g/mol. Its IUPAC name is 1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid
PubChem CID117251414
Molecular FormulaC14H8Cl2N2O2
Molecular Weight307.14 g/mol
Exact Mass306.00
IUPAC Name1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid
SMILESO=C(O)c1ccc2c(Cl)nc(-c3ccc(Cl)cc3)n2c1
InChIInChI=1S/C14H8Cl2N2O2/c15-10-4-1-8(2-5-10)13-17-12(16)11-6-3-9(14(19)20)7-18(11)13/h1-7H,(H,19,20)
InChIKeyDJEMUSJUELFYOW-UHFFFAOYSA-N
XLogP4.01
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.14
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-chloro-3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid
CID 117251411
1-chloro-3-pyridin-2-ylimidazo[1,5-a]pyridine-6-carboxylic acid
CID 117251203
3-(2-carboxyethyl)-1-chloroimidazo[1,5-a]pyridine-6-carboxylic acid
CID 84743043
1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid
CID 83870930
1-chloro-3-(4-fluorophenyl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 117251989
1-chloro-3-[2-(methylamino)ethyl]imidazo[1,5-a]pyridine-6-carboxylic acid
CID 84742150
3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 28752075
2-(4-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole-6-carboxylic acid
CID 20886950
1-chloro-3-pyridin-4-ylimidazo[1,5-a]pyridin-6-ol
CID 117251530
1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridin-7-ol
CID 117252012
4-chloro(13C)benzoic acid
CID 66995527
3-(3-chloro-4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid
CID 82878738

Frequently Asked Questions

What is the IUPAC name of 1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid?
The IUPAC name of 1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid (CID 117251414) is 1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid.
What is the SMILES notation for 1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid?
The canonical SMILES for 1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid is O=C(O)c1ccc2c(Cl)nc(-c3ccc(Cl)cc3)n2c1.
What is the InChIKey of 1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid?
The InChIKey is DJEMUSJUELFYOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2N2O2/c15-10-4-1-8(2-5-10)13-17-12(16)11-6-3-9(14(19)20)7-18(11)13/h1-7H,(H,19,20).
What are the key properties of 1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid?
1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid has a molecular weight of 307.14 g/mol, XLogP of 4.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid is sourced from PubChem (CID 117251414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).