3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide

C21H20N4OS — CID 59419621

IUPAC3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide
SMILESCC(C)(C(=O)Nc1nccs1)C(c1ccccc1)c1ccn2cncc2c1
InChIInChI=1S/C21H20N4OS/c1-21(2,19(26)24-20-23-9-11-27-20)18(15-6-4-3-5-7-15)16-8-10-25-14-22-13-17(25)12-16/h3-14,18H,1-2H3,(H,23,24,26)
InChIKeyXHDKJGIOKHXSGM-UHFFFAOYSA-N
MW376.49 g/mol
LogP4.59
Rot. Bonds5

About 3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide

3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide (PubChem CID 59419621) has the molecular formula C21H20N4OS and a molecular weight of 376.49 g/mol. Its IUPAC name is 3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide
PubChem CID59419621
Molecular FormulaC21H20N4OS
Molecular Weight376.49 g/mol
Exact Mass376.14
IUPAC Name3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide
SMILESCC(C)(C(=O)Nc1nccs1)C(c1ccccc1)c1ccn2cncc2c1
InChIInChI=1S/C21H20N4OS/c1-21(2,19(26)24-20-23-9-11-27-20)18(15-6-4-3-5-7-15)16-8-10-25-14-22-13-17(25)12-16/h3-14,18H,1-2H3,(H,23,24,26)
InChIKeyXHDKJGIOKHXSGM-UHFFFAOYSA-N
XLogP4.59
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.49
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide?
The IUPAC name of 3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide (CID 59419621) is 3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide is CC(C)(C(=O)Nc1nccs1)C(c1ccccc1)c1ccn2cncc2c1.
What is the InChIKey of 3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide?
The InChIKey is XHDKJGIOKHXSGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4OS/c1-21(2,19(26)24-20-23-9-11-27-20)18(15-6-4-3-5-7-15)16-8-10-25-14-22-13-17(25)12-16/h3-14,18H,1-2H3,(H,23,24,26).
What are the key properties of 3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide?
3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide has a molecular weight of 376.49 g/mol, XLogP of 4.59, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazo[1,5-a]pyridin-7-yl-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 59419621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).