N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide

C22H23N3OS — CID 2464292

IUPACN-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide
SMILESCCN1CCc2nc(NC(=O)C(c3ccccc3)c3ccccc3)sc2C1
InChIInChI=1S/C22H23N3OS/c1-2-25-14-13-18-19(15-25)27-22(23-18)24-21(26)20(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,20H,2,13-15H2,1H3,(H,23,24,26)
InChIKeyTURUGYAHLFATBO-UHFFFAOYSA-N
MW377.51 g/mol
LogP4.29
Rot. Bonds5

About N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide

N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide (PubChem CID 2464292) has the molecular formula C22H23N3OS and a molecular weight of 377.51 g/mol. Its IUPAC name is N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide
PubChem CID2464292
Molecular FormulaC22H23N3OS
Molecular Weight377.51 g/mol
Exact Mass377.16
IUPAC NameN-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide
SMILESCCN1CCc2nc(NC(=O)C(c3ccccc3)c3ccccc3)sc2C1
InChIInChI=1S/C22H23N3OS/c1-2-25-14-13-18-19(15-25)27-22(23-18)24-21(26)20(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,20H,2,13-15H2,1H3,(H,23,24,26)
InChIKeyTURUGYAHLFATBO-UHFFFAOYSA-N
XLogP4.29
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.51
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide?
The IUPAC name of N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide (CID 2464292) is N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide.
What is the SMILES notation for N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide?
The canonical SMILES for N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide is CCN1CCc2nc(NC(=O)C(c3ccccc3)c3ccccc3)sc2C1.
What is the InChIKey of N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide?
The InChIKey is TURUGYAHLFATBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3OS/c1-2-25-14-13-18-19(15-25)27-22(23-18)24-21(26)20(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,20H,2,13-15H2,1H3,(H,23,24,26).
What are the key properties of N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide?
N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide has a molecular weight of 377.51 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2,2-diphenylacetamide is sourced from PubChem (CID 2464292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).