2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide

C16H16ClN3OS — CID 7522218

IUPAC2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cc1csc2nc(-c3ccc(Cl)cc3)cn12
InChIInChI=1S/C16H16ClN3OS/c1-10(2)18-15(21)7-13-9-22-16-19-14(8-20(13)16)11-3-5-12(17)6-4-11/h3-6,8-10H,7H2,1-2H3,(H,18,21)
InChIKeyZXEHCRXVNCBXPX-UHFFFAOYSA-N
MW333.84 g/mol
LogP3.78
Rot. Bonds4

About 2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide

2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide (PubChem CID 7522218) has the molecular formula C16H16ClN3OS and a molecular weight of 333.84 g/mol. Its IUPAC name is 2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide
PubChem CID7522218
Molecular FormulaC16H16ClN3OS
Molecular Weight333.84 g/mol
Exact Mass333.07
IUPAC Name2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cc1csc2nc(-c3ccc(Cl)cc3)cn12
InChIInChI=1S/C16H16ClN3OS/c1-10(2)18-15(21)7-13-9-22-16-19-14(8-20(13)16)11-3-5-12(17)6-4-11/h3-6,8-10H,7H2,1-2H3,(H,18,21)
InChIKeyZXEHCRXVNCBXPX-UHFFFAOYSA-N
XLogP3.78
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.84
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide?
The IUPAC name of 2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide (CID 7522218) is 2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide is CC(C)NC(=O)Cc1csc2nc(-c3ccc(Cl)cc3)cn12.
What is the InChIKey of 2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide?
The InChIKey is ZXEHCRXVNCBXPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClN3OS/c1-10(2)18-15(21)7-13-9-22-16-19-14(8-20(13)16)11-3-5-12(17)6-4-11/h3-6,8-10H,7H2,1-2H3,(H,18,21).
What are the key properties of 2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide?
2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide has a molecular weight of 333.84 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-propan-2-ylacetamide is sourced from PubChem (CID 7522218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).