4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide

C15H14N4O2S — CID 134027726

IUPAC4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide
SMILESCC(=O)Nc1ccc(C(=O)NCc2cn3ccsc3n2)cc1
InChIInChI=1S/C15H14N4O2S/c1-10(20)17-12-4-2-11(3-5-12)14(21)16-8-13-9-19-6-7-22-15(19)18-13/h2-7,9H,8H2,1H3,(H,16,21)(H,17,20)
InChIKeyITVWFRVJDODFPA-UHFFFAOYSA-N
MW314.37 g/mol
LogP2.28
Rot. Bonds4

About 4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide

4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide (PubChem CID 134027726) has the molecular formula C15H14N4O2S and a molecular weight of 314.37 g/mol. Its IUPAC name is 4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide.

Molecular Properties

Compound Name4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide
PubChem CID134027726
Molecular FormulaC15H14N4O2S
Molecular Weight314.37 g/mol
Exact Mass314.08
IUPAC Name4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide
SMILESCC(=O)Nc1ccc(C(=O)NCc2cn3ccsc3n2)cc1
InChIInChI=1S/C15H14N4O2S/c1-10(20)17-12-4-2-11(3-5-12)14(21)16-8-13-9-19-6-7-22-15(19)18-13/h2-7,9H,8H2,1H3,(H,16,21)(H,17,20)
InChIKeyITVWFRVJDODFPA-UHFFFAOYSA-N
XLogP2.28
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.37
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-methoxybenzamide
CID 3658662
4-cyano-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide
CID 134025287
N-[3-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)phenyl]acetamide
CID 115331463
N-[4-[[(2-imidazo[2,1-b][1,3]thiazol-6-ylacetyl)amino]methyl]phenyl]butanamide
CID 55781902
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 55561183
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-3-methylsulfonylbenzamide
CID 134027697
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-morpholin-4-ylsulfonylbenzamide
CID 3887000
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]benzamide
CID 91642422
4-acetamido-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 110445281
4-(difluoromethoxy)-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-3-methoxybenzamide
CID 52563386
4-tert-butyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-3-nitrobenzamide
CID 78858316
4-tert-butyl-N-[2-(4-imidazo[2,1-b][1,3]thiazol-6-ylanilino)-2-oxoethyl]benzamide
CID 46674582

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide?
The IUPAC name of 4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide (CID 134027726) is 4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide.
What is the SMILES notation for 4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide?
The canonical SMILES for 4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide is CC(=O)Nc1ccc(C(=O)NCc2cn3ccsc3n2)cc1.
What is the InChIKey of 4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide?
The InChIKey is ITVWFRVJDODFPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2S/c1-10(20)17-12-4-2-11(3-5-12)14(21)16-8-13-9-19-6-7-22-15(19)18-13/h2-7,9H,8H2,1H3,(H,16,21)(H,17,20).
What are the key properties of 4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide?
4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide has a molecular weight of 314.37 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide is sourced from PubChem (CID 134027726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).