6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid

C17H15ClN2O3 — CID 161094919

IUPAC6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid
SMILESCOc1ccc(Cl)cc1CCc1ccc2ncc(C(=O)O)n2c1
InChIInChI=1S/C17H15ClN2O3/c1-23-15-6-5-13(18)8-12(15)4-2-11-3-7-16-19-9-14(17(21)22)20(16)10-11/h3,5-10H,2,4H2,1H3,(H,21,22)
InChIKeyIJCMUGOPKSIHSI-UHFFFAOYSA-N
MW330.77 g/mol
LogP3.48
Rot. Bonds5

About 6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid

6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid (PubChem CID 161094919) has the molecular formula C17H15ClN2O3 and a molecular weight of 330.77 g/mol. Its IUPAC name is 6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid
PubChem CID161094919
Molecular FormulaC17H15ClN2O3
Molecular Weight330.77 g/mol
Exact Mass330.08
IUPAC Name6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid
SMILESCOc1ccc(Cl)cc1CCc1ccc2ncc(C(=O)O)n2c1
InChIInChI=1S/C17H15ClN2O3/c1-23-15-6-5-13(18)8-12(15)4-2-11-3-7-16-19-9-14(17(21)22)20(16)10-11/h3,5-10H,2,4H2,1H3,(H,21,22)
InChIKeyIJCMUGOPKSIHSI-UHFFFAOYSA-N
XLogP3.48
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.77
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-chloro-2-methoxyphenyl)ethylcarbamic acid
CID 115171089
5-(5-chloro-2-methoxyphenyl)pentanoic acid
CID 93186212
7-chloroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 55265824
1-benzyl-4-[2-(5-chloro-2-methoxyphenyl)ethyl]triazole
CID 112718716
4-(5-chloro-2-methoxyphenyl)-2,2-dimethylbutanoic acid
CID 82120597
1-[(5-chloro-2-methoxyphenyl)methyl]triazole-4-carboxylic acid
CID 62059281
2-[(5-chloro-2-methoxyphenyl)methoxy]-5-methylbenzoic acid
CID 60711590
4-[[(5-chloro-2-methoxyphenyl)methylamino]methyl]benzoic acid
CID 4723343
2-[2-(5-chloro-2-methoxyphenyl)ethyl-methylamino]acetic acid
CID 112519079
2-[5-chloro-2-[(4-methoxyphenyl)methoxy]phenyl]acetic acid
CID 139026989
1-(5-chloro-2-methoxyphenyl)-3-(2-methoxyphenyl)propan-2-one
CID 62620437
[3-[(5-chloro-2-methoxyphenyl)methyl]triazol-4-yl]-phenylmethanone
CID 11163239

Frequently Asked Questions

What is the IUPAC name of 6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid?
The IUPAC name of 6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid (CID 161094919) is 6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid?
The canonical SMILES for 6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid is COc1ccc(Cl)cc1CCc1ccc2ncc(C(=O)O)n2c1.
What is the InChIKey of 6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid?
The InChIKey is IJCMUGOPKSIHSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2O3/c1-23-15-6-5-13(18)8-12(15)4-2-11-3-7-16-19-9-14(17(21)22)20(16)10-11/h3,5-10H,2,4H2,1H3,(H,21,22).
What are the key properties of 6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid?
6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid has a molecular weight of 330.77 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(5-chloro-2-methoxyphenyl)ethyl]imidazo[1,2-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 161094919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).