ethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid

C20H22N4O2S — CID 144870523

IUPACethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid
SMILESCC.CCc1ccnn1-c1cc(C(=O)O)cn2c(-c3ccc(C)s3)cnc12
InChIInChI=1S/C18H16N4O2S.C2H6/c1-3-13-6-7-20-22(13)14-8-12(18(23)24)10-21-15(9-19-17(14)21)16-5-4-11(2)25-16;1-2/h4-10H,3H2,1-2H3,(H,23,24);1-2H3
InChIKeyWQTBFACRVRZGNT-UHFFFAOYSA-N
MW382.49 g/mol
LogP4.84
Rot. Bonds4

About ethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid

ethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid (PubChem CID 144870523) has the molecular formula C20H22N4O2S and a molecular weight of 382.49 g/mol. Its IUPAC name is ethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid.

Molecular Properties

Compound Nameethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid
PubChem CID144870523
Molecular FormulaC20H22N4O2S
Molecular Weight382.49 g/mol
Exact Mass382.15
IUPAC Nameethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid
SMILESCC.CCc1ccnn1-c1cc(C(=O)O)cn2c(-c3ccc(C)s3)cnc12
InChIInChI=1S/C18H16N4O2S.C2H6/c1-3-13-6-7-20-22(13)14-8-12(18(23)24)10-21-15(9-19-17(14)21)16-5-4-11(2)25-16;1-2/h4-10H,3H2,1-2H3,(H,23,24);1-2H3
InChIKeyWQTBFACRVRZGNT-UHFFFAOYSA-N
XLogP4.84
TPSA72.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.49
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze ethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-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

6-(5-Methylthiophen-2-yl)-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxylic acid
CID 71600936
5-[7-[1-[2-(Dimethylamino)ethyl]pyrazol-4-yl]imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide
CID 164622155
US11584755, Example 144
CID 138512818
ethyl 5-((2-((1-methyl-1H-pyrazol-4-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methyl)thiophene-2-carboxylate
CID 155280512
6-methyl-1-[(thiophen-2-yl)methyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
CID 17476063
6-[2-[2-(Dimethylamino)-3-methylimidazol-4-yl]ethenyl]-1,3-dimethylpyrazolo[3,4-b]pyridine-4-carboxylic acid
CID 136549723
2-Ethyl-7-[3-[[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carbonyl]amino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 69191870
Methyl 8-[5-(difluoromethyl)tetrazol-1-yl]-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylate
CID 118168005
8-[5-(Difluoromethyl)tetrazol-1-yl]-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid
CID 118168171
Methyl 8-[5-(difluoromethyl)-4-ethoxycarbonyltriazol-1-yl]-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylate
CID 118168311
8-[5-(Difluoromethyl)triazol-1-yl]-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid
CID 118168504
8-[4-Carboxy-5-(difluoromethyl)triazol-1-yl]-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid
CID 118180362

Frequently Asked Questions

What is the IUPAC name of ethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The IUPAC name of ethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid (CID 144870523) is ethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid.
What is the SMILES notation for ethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The canonical SMILES for ethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid is CC.CCc1ccnn1-c1cc(C(=O)O)cn2c(-c3ccc(C)s3)cnc12.
What is the InChIKey of ethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The InChIKey is WQTBFACRVRZGNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O2S.C2H6/c1-3-13-6-7-20-22(13)14-8-12(18(23)24)10-21-15(9-19-17(14)21)16-5-4-11(2)25-16;1-2/h4-10H,3H2,1-2H3,(H,23,24);1-2H3.
What are the key properties of ethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid?
ethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid has a molecular weight of 382.49 g/mol, XLogP of 4.84, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;8-(5-ethylpyrazol-1-yl)-3-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine-6-carboxylic acid is sourced from PubChem (CID 144870523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).