3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid

C15H11ClN2O2 — CID 117145233

IUPAC3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid
SMILESO=C(O)c1ccn2c(Cc3ccccc3Cl)ncc2c1
InChIInChI=1S/C15H11ClN2O2/c16-13-4-2-1-3-10(13)8-14-17-9-12-7-11(15(19)20)5-6-18(12)14/h1-7,9H,8H2,(H,19,20)
InChIKeyBHUYTBMYMBDBEL-UHFFFAOYSA-N
MW286.72 g/mol
LogP3.28
Rot. Bonds3

About 3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid

3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid (PubChem CID 117145233) has the molecular formula C15H11ClN2O2 and a molecular weight of 286.72 g/mol. Its IUPAC name is 3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid.

Molecular Properties

Compound Name3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid
PubChem CID117145233
Molecular FormulaC15H11ClN2O2
Molecular Weight286.72 g/mol
Exact Mass286.05
IUPAC Name3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid
SMILESO=C(O)c1ccn2c(Cc3ccccc3Cl)ncc2c1
InChIInChI=1S/C15H11ClN2O2/c16-13-4-2-1-3-10(13)8-14-17-9-12-7-11(15(19)20)5-6-18(12)14/h1-7,9H,8H2,(H,19,20)
InChIKeyBHUYTBMYMBDBEL-UHFFFAOYSA-N
XLogP3.28
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.72
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-fluorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid
CID 117145232
3-(2-carboxyethyl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 84741033
3-[[2-[(2-chlorophenyl)methyl]imidazol-1-yl]methyl]benzoic acid
CID 82560021
5-[(2-chlorophenyl)methyl]-4-methyl-1,2,4-triazole-3-carboxylic acid
CID 19904237
3-[(2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine-7-carboxylic acid
CID 117256587
methyl 3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylate
CID 117145255
2-[2-[(2-chlorophenyl)methyl]imidazol-1-yl]acetic acid
CID 82560014
7-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine
CID 117144494
2-(imidazo[1,5-a]pyridin-3-ylmethyl)phenol
CID 117139622
3-[(1,1-dioxothian-2-yl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid
CID 117145133
7-bromo-3-[(2-fluorophenyl)methyl]imidazo[1,5-a]pyridine
CID 117144523
methyl 3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridine-7-carboxylate
CID 117145337

Frequently Asked Questions

What is the IUPAC name of 3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid?
The IUPAC name of 3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid (CID 117145233) is 3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid.
What is the SMILES notation for 3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid?
The canonical SMILES for 3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid is O=C(O)c1ccn2c(Cc3ccccc3Cl)ncc2c1.
What is the InChIKey of 3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid?
The InChIKey is BHUYTBMYMBDBEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O2/c16-13-4-2-1-3-10(13)8-14-17-9-12-7-11(15(19)20)5-6-18(12)14/h1-7,9H,8H2,(H,19,20).
What are the key properties of 3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid?
3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid has a molecular weight of 286.72 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid is sourced from PubChem (CID 117145233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).