ethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate

C19H17N5O2 — CID 134202579

IUPACethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate
SMILESCCOC(=O)c1[nH]nc(-c2cccc(C)n2)c1-c1ccc2nccn2c1
InChIInChI=1S/C19H17N5O2/c1-3-26-19(25)18-16(13-7-8-15-20-9-10-24(15)11-13)17(22-23-18)14-6-4-5-12(2)21-14/h4-11H,3H2,1-2H3,(H,22,23)
InChIKeyTVSVHHGWRFKUIT-UHFFFAOYSA-N
MW347.38 g/mol
LogP3.27
Rot. Bonds4

About ethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate

ethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate (PubChem CID 134202579) has the molecular formula C19H17N5O2 and a molecular weight of 347.38 g/mol. Its IUPAC name is ethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate.

Molecular Properties

Compound Nameethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate
PubChem CID134202579
Molecular FormulaC19H17N5O2
Molecular Weight347.38 g/mol
Exact Mass347.14
IUPAC Nameethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate
SMILESCCOC(=O)c1[nH]nc(-c2cccc(C)n2)c1-c1ccc2nccn2c1
InChIInChI=1S/C19H17N5O2/c1-3-26-19(25)18-16(13-7-8-15-20-9-10-24(15)11-13)17(22-23-18)14-6-4-5-12(2)21-14/h4-11H,3H2,1-2H3,(H,22,23)
InChIKeyTVSVHHGWRFKUIT-UHFFFAOYSA-N
XLogP3.27
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.38
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of ethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate?
The IUPAC name of ethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate (CID 134202579) is ethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate.
What is the SMILES notation for ethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate?
The canonical SMILES for ethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate is CCOC(=O)c1[nH]nc(-c2cccc(C)n2)c1-c1ccc2nccn2c1.
What is the InChIKey of ethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate?
The InChIKey is TVSVHHGWRFKUIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2/c1-3-26-19(25)18-16(13-7-8-15-20-9-10-24(15)11-13)17(22-23-18)14-6-4-5-12(2)21-14/h4-11H,3H2,1-2H3,(H,22,23).
What are the key properties of ethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate?
ethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate has a molecular weight of 347.38 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-imidazo[1,2-a]pyridin-6-yl-3-(6-methyl-2-pyridinyl)-1H-pyrazole-5-carboxylate is sourced from PubChem (CID 134202579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).