(2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone

C19H21N3O2S — CID 3244991

IUPAC(2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone
SMILESCc1c(C(=O)N2CC(C)OC(C)C2)sc2nc(-c3ccccc3)cn12
InChIInChI=1S/C19H21N3O2S/c1-12-9-21(10-13(2)24-12)18(23)17-14(3)22-11-16(20-19(22)25-17)15-7-5-4-6-8-15/h4-8,11-13H,9-10H2,1-3H3
InChIKeyFBZLESXIWIWSTG-UHFFFAOYSA-N
MW355.46 g/mol
LogP3.62
Rot. Bonds2

About (2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone

(2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone (PubChem CID 3244991) has the molecular formula C19H21N3O2S and a molecular weight of 355.46 g/mol. Its IUPAC name is (2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone.

Molecular Properties

Compound Name(2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone
PubChem CID3244991
Molecular FormulaC19H21N3O2S
Molecular Weight355.46 g/mol
Exact Mass355.14
IUPAC Name(2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone
SMILESCc1c(C(=O)N2CC(C)OC(C)C2)sc2nc(-c3ccccc3)cn12
InChIInChI=1S/C19H21N3O2S/c1-12-9-21(10-13(2)24-12)18(23)17-14(3)22-11-16(20-19(22)25-17)15-7-5-4-6-8-15/h4-8,11-13H,9-10H2,1-3H3
InChIKeyFBZLESXIWIWSTG-UHFFFAOYSA-N
XLogP3.62
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.46
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone?
The IUPAC name of (2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone (CID 3244991) is (2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone.
What is the SMILES notation for (2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone?
The canonical SMILES for (2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone is Cc1c(C(=O)N2CC(C)OC(C)C2)sc2nc(-c3ccccc3)cn12.
What is the InChIKey of (2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone?
The InChIKey is FBZLESXIWIWSTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2S/c1-12-9-21(10-13(2)24-12)18(23)17-14(3)22-11-16(20-19(22)25-17)15-7-5-4-6-8-15/h4-8,11-13H,9-10H2,1-3H3.
What are the key properties of (2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone?
(2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone has a molecular weight of 355.46 g/mol, XLogP of 3.62, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylmorpholin-4-yl)-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone is sourced from PubChem (CID 3244991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).