N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide

C14H15N3O2S — CID 40506262

IUPACN-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide
SMILESCOCC(=O)Nc1cccc(-c2cn3c(n2)SCC3)c1
InChIInChI=1S/C14H15N3O2S/c1-19-9-13(18)15-11-4-2-3-10(7-11)12-8-17-5-6-20-14(17)16-12/h2-4,7-8H,5-6,9H2,1H3,(H,15,18)
InChIKeyLQNYPWLCKTWXFF-UHFFFAOYSA-N
MW289.36 g/mol
LogP2.24
Rot. Bonds4

About N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide

N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide (PubChem CID 40506262) has the molecular formula C14H15N3O2S and a molecular weight of 289.36 g/mol. Its IUPAC name is N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide
PubChem CID40506262
Molecular FormulaC14H15N3O2S
Molecular Weight289.36 g/mol
Exact Mass289.09
IUPAC NameN-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide
SMILESCOCC(=O)Nc1cccc(-c2cn3c(n2)SCC3)c1
InChIInChI=1S/C14H15N3O2S/c1-19-9-13(18)15-11-4-2-3-10(7-11)12-8-17-5-6-20-14(17)16-12/h2-4,7-8H,5-6,9H2,1H3,(H,15,18)
InChIKeyLQNYPWLCKTWXFF-UHFFFAOYSA-N
XLogP2.24
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.36
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide?
The IUPAC name of N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide (CID 40506262) is N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide.
What is the SMILES notation for N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide?
The canonical SMILES for N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide is COCC(=O)Nc1cccc(-c2cn3c(n2)SCC3)c1.
What is the InChIKey of N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide?
The InChIKey is LQNYPWLCKTWXFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2S/c1-19-9-13(18)15-11-4-2-3-10(7-11)12-8-17-5-6-20-14(17)16-12/h2-4,7-8H,5-6,9H2,1H3,(H,15,18).
What are the key properties of N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide?
N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide has a molecular weight of 289.36 g/mol, XLogP of 2.24, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-methoxyacetamide is sourced from PubChem (CID 40506262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).