N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide

C17H19N3O3S — CID 71937392

IUPACN-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide
SMILESO=C(Cc1cn2ccsc2n1)N(Cc1ccco1)CC1CCCO1
InChIInChI=1S/C17H19N3O3S/c21-16(9-13-10-19-5-8-24-17(19)18-13)20(11-14-3-1-6-22-14)12-15-4-2-7-23-15/h1,3,5-6,8,10,15H,2,4,7,9,11-12H2
InChIKeyFZCQPEDAWOQIIR-UHFFFAOYSA-N
MW345.42 g/mol
LogP2.74
Rot. Bonds6

About N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide

N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide (PubChem CID 71937392) has the molecular formula C17H19N3O3S and a molecular weight of 345.42 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide
PubChem CID71937392
Molecular FormulaC17H19N3O3S
Molecular Weight345.42 g/mol
Exact Mass345.11
IUPAC NameN-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide
SMILESO=C(Cc1cn2ccsc2n1)N(Cc1ccco1)CC1CCCO1
InChIInChI=1S/C17H19N3O3S/c21-16(9-13-10-19-5-8-24-17(19)18-13)20(11-14-3-1-6-22-14)12-15-4-2-7-23-15/h1,3,5-6,8,10,15H,2,4,7,9,11-12H2
InChIKeyFZCQPEDAWOQIIR-UHFFFAOYSA-N
XLogP2.74
TPSA59.98 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.42
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide (CID 71937392) is N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide is O=C(Cc1cn2ccsc2n1)N(Cc1ccco1)CC1CCCO1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide?
The InChIKey is FZCQPEDAWOQIIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3S/c21-16(9-13-10-19-5-8-24-17(19)18-13)20(11-14-3-1-6-22-14)12-15-4-2-7-23-15/h1,3,5-6,8,10,15H,2,4,7,9,11-12H2.
What are the key properties of N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide?
N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide has a molecular weight of 345.42 g/mol, XLogP of 2.74, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(oxolan-2-ylmethyl)acetamide is sourced from PubChem (CID 71937392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).