N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide

C16H20N4O2S — CID 71856428

IUPACN-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
SMILESCN(C)CCN(Cc1ccco1)C(=O)Cc1cn2ccsc2n1
InChIInChI=1S/C16H20N4O2S/c1-18(2)5-6-19(12-14-4-3-8-22-14)15(21)10-13-11-20-7-9-23-16(20)17-13/h3-4,7-9,11H,5-6,10,12H2,1-2H3
InChIKeyIJRVTVASZYEVRY-UHFFFAOYSA-N
MW332.43 g/mol
LogP2.12
Rot. Bonds7

About N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide

N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide (PubChem CID 71856428) has the molecular formula C16H20N4O2S and a molecular weight of 332.43 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
PubChem CID71856428
Molecular FormulaC16H20N4O2S
Molecular Weight332.43 g/mol
Exact Mass332.13
IUPAC NameN-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
SMILESCN(C)CCN(Cc1ccco1)C(=O)Cc1cn2ccsc2n1
InChIInChI=1S/C16H20N4O2S/c1-18(2)5-6-19(12-14-4-3-8-22-14)15(21)10-13-11-20-7-9-23-16(20)17-13/h3-4,7-9,11H,5-6,10,12H2,1-2H3
InChIKeyIJRVTVASZYEVRY-UHFFFAOYSA-N
XLogP2.12
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide (CID 71856428) is N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide is CN(C)CCN(Cc1ccco1)C(=O)Cc1cn2ccsc2n1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The InChIKey is IJRVTVASZYEVRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2S/c1-18(2)5-6-19(12-14-4-3-8-22-14)15(21)10-13-11-20-7-9-23-16(20)17-13/h3-4,7-9,11H,5-6,10,12H2,1-2H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide has a molecular weight of 332.43 g/mol, XLogP of 2.12, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-N-(furan-2-ylmethyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide is sourced from PubChem (CID 71856428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).