4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide

C21H20N6O2 — CID 51033482

IUPAC4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide
SMILESCN(C)C(=O)c1cnn(C)c1C(=O)Nc1ccn2cc(-c3ccccc3)nc2c1
InChIInChI=1S/C21H20N6O2/c1-25(2)21(29)16-12-22-26(3)19(16)20(28)23-15-9-10-27-13-17(24-18(27)11-15)14-7-5-4-6-8-14/h4-13H,1-3H3,(H,23,28)
InChIKeyBVARGKCDJUUMRO-UHFFFAOYSA-N
MW388.43 g/mol
LogP2.69
Rot. Bonds4

About 4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide

4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide (PubChem CID 51033482) has the molecular formula C21H20N6O2 and a molecular weight of 388.43 g/mol. Its IUPAC name is 4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide.

Molecular Properties

Compound Name4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide
PubChem CID51033482
Molecular FormulaC21H20N6O2
Molecular Weight388.43 g/mol
Exact Mass388.16
IUPAC Name4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide
SMILESCN(C)C(=O)c1cnn(C)c1C(=O)Nc1ccn2cc(-c3ccccc3)nc2c1
InChIInChI=1S/C21H20N6O2/c1-25(2)21(29)16-12-22-26(3)19(16)20(28)23-15-9-10-27-13-17(24-18(27)11-15)14-7-5-4-6-8-14/h4-13H,1-3H3,(H,23,28)
InChIKeyBVARGKCDJUUMRO-UHFFFAOYSA-N
XLogP2.69
TPSA84.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.43
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide?
The IUPAC name of 4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide (CID 51033482) is 4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide.
What is the SMILES notation for 4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide?
The canonical SMILES for 4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide is CN(C)C(=O)c1cnn(C)c1C(=O)Nc1ccn2cc(-c3ccccc3)nc2c1.
What is the InChIKey of 4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide?
The InChIKey is BVARGKCDJUUMRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N6O2/c1-25(2)21(29)16-12-22-26(3)19(16)20(28)23-15-9-10-27-13-17(24-18(27)11-15)14-7-5-4-6-8-14/h4-13H,1-3H3,(H,23,28).
What are the key properties of 4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide?
4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide has a molecular weight of 388.43 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N,1-trimethyl-5-N-(2-phenylimidazo[1,2-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide is sourced from PubChem (CID 51033482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).