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

C19H21N3OS — CID 3610141

IUPAC(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-(2-methylpiperidin-1-yl)methanone
SMILESCc1c(C(=O)N2CCCCC2C)sc2nc(-c3ccccc3)cn12
InChIInChI=1S/C19H21N3OS/c1-13-8-6-7-11-21(13)18(23)17-14(2)22-12-16(20-19(22)24-17)15-9-4-3-5-10-15/h3-5,9-10,12-13H,6-8,11H2,1-2H3
InChIKeyQOZQAKZKMDMEAX-UHFFFAOYSA-N
MW339.46 g/mol
LogP4.39
Rot. Bonds2

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

(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-(2-methylpiperidin-1-yl)methanone (PubChem CID 3610141) has the molecular formula C19H21N3OS and a molecular weight of 339.46 g/mol. Its IUPAC name is (3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-(2-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-(2-methylpiperidin-1-yl)methanone
PubChem CID3610141
Molecular FormulaC19H21N3OS
Molecular Weight339.46 g/mol
Exact Mass339.14
IUPAC Name(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-(2-methylpiperidin-1-yl)methanone
SMILESCc1c(C(=O)N2CCCCC2C)sc2nc(-c3ccccc3)cn12
InChIInChI=1S/C19H21N3OS/c1-13-8-6-7-11-21(13)18(23)17-14(2)22-12-16(20-19(22)24-17)15-9-4-3-5-10-15/h3-5,9-10,12-13H,6-8,11H2,1-2H3
InChIKeyQOZQAKZKMDMEAX-UHFFFAOYSA-N
XLogP4.39
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.46
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-morpholin-4-ylmethanone
CID 3245660
3,4-dihydro-1H-isoquinolin-2-yl-(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)methanone
CID 3245021
(2-amino-4-phenyl-1,3-thiazol-5-yl)-(2-methylpiperidin-1-yl)methanone
CID 82035057
(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-[4-(2-phenylethyl)piperazin-1-yl]methanone
CID 121031660
[6-(4-fluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazol-2-yl]-[(3R)-3-methylpiperidin-1-yl]methanone
CID 29312797
N'-benzoyl-3-methyl-6-phenylimidazo[2,1-b][1,3]thiazole-2-carbohydrazide
CID 19164108
(2-methylpiperidin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 3158156
[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]-(2-methylpiperidin-1-yl)methanone
CID 24537550
1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone
CID 19224511
[(2S)-2-methylpiperidin-1-yl]-(5-phenylthiadiazol-4-yl)methanone
CID 95739175
ethyl 1-[3-methyl-6-(3-nitrophenyl)imidazo[2,1-b][1,3]thiazole-2-carbonyl]piperidine-3-carboxylate
CID 43953532
N-(1,3-benzothiazol-2-yl)-3-methyl-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 7080139

Frequently Asked Questions

What is the IUPAC name of (3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-(2-methylpiperidin-1-yl)methanone?
The IUPAC name of (3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-(2-methylpiperidin-1-yl)methanone (CID 3610141) is (3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-(2-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-(2-methylpiperidin-1-yl)methanone?
The canonical SMILES for (3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-(2-methylpiperidin-1-yl)methanone is Cc1c(C(=O)N2CCCCC2C)sc2nc(-c3ccccc3)cn12.
What is the InChIKey of (3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-(2-methylpiperidin-1-yl)methanone?
The InChIKey is QOZQAKZKMDMEAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3OS/c1-13-8-6-7-11-21(13)18(23)17-14(2)22-12-16(20-19(22)24-17)15-9-4-3-5-10-15/h3-5,9-10,12-13H,6-8,11H2,1-2H3.
What are the key properties of (3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-(2-methylpiperidin-1-yl)methanone?
(3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-(2-methylpiperidin-1-yl)methanone has a molecular weight of 339.46 g/mol, XLogP of 4.39, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-6-phenylimidazo[2,1-b][1,3]thiazol-2-yl)-(2-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 3610141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).