2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide

C17H19N5O2S — CID 18139618

IUPAC2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide
SMILESO=C(Cc1cn2ccsc2n1)NCc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C17H19N5O2S/c23-16(9-14-12-22-5-8-25-17(22)20-14)19-11-13-1-2-15(18-10-13)21-3-6-24-7-4-21/h1-2,5,8,10,12H,3-4,6-7,9,11H2,(H,19,23)
InChIKeyVDLYBUWOCCALBI-UHFFFAOYSA-N
MW357.44 g/mol
LogP1.49
Rot. Bonds5

About 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide

2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide (PubChem CID 18139618) has the molecular formula C17H19N5O2S and a molecular weight of 357.44 g/mol. Its IUPAC name is 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide
PubChem CID18139618
Molecular FormulaC17H19N5O2S
Molecular Weight357.44 g/mol
Exact Mass357.13
IUPAC Name2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide
SMILESO=C(Cc1cn2ccsc2n1)NCc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C17H19N5O2S/c23-16(9-14-12-22-5-8-25-17(22)20-14)19-11-13-1-2-15(18-10-13)21-3-6-24-7-4-21/h1-2,5,8,10,12H,3-4,6-7,9,11H2,(H,19,23)
InChIKeyVDLYBUWOCCALBI-UHFFFAOYSA-N
XLogP1.49
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.44
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide?
The IUPAC name of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide (CID 18139618) is 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide is O=C(Cc1cn2ccsc2n1)NCc1ccc(N2CCOCC2)nc1.
What is the InChIKey of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide?
The InChIKey is VDLYBUWOCCALBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O2S/c23-16(9-14-12-22-5-8-25-17(22)20-14)19-11-13-1-2-15(18-10-13)21-3-6-24-7-4-21/h1-2,5,8,10,12H,3-4,6-7,9,11H2,(H,19,23).
What are the key properties of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide?
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide has a molecular weight of 357.44 g/mol, XLogP of 1.49, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide is sourced from PubChem (CID 18139618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).