(4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone

C14H14N4O2S — CID 125014377

IUPAC(4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone
SMILESO=C(c1cnco1)N1CCC(c2csc3nccn23)CC1
InChIInChI=1S/C14H14N4O2S/c19-13(12-7-15-9-20-12)17-4-1-10(2-5-17)11-8-21-14-16-3-6-18(11)14/h3,6-10H,1-2,4-5H2
InChIKeyWLWFYYWPBIVXMO-UHFFFAOYSA-N
MW302.36 g/mol
LogP2.40
Rot. Bonds2

About (4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone

(4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone (PubChem CID 125014377) has the molecular formula C14H14N4O2S and a molecular weight of 302.36 g/mol. Its IUPAC name is (4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone.

Molecular Properties

Compound Name(4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone
PubChem CID125014377
Molecular FormulaC14H14N4O2S
Molecular Weight302.36 g/mol
Exact Mass302.08
IUPAC Name(4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone
SMILESO=C(c1cnco1)N1CCC(c2csc3nccn23)CC1
InChIInChI=1S/C14H14N4O2S/c19-13(12-7-15-9-20-12)17-4-1-10(2-5-17)11-8-21-14-16-3-6-18(11)14/h3,6-10H,1-2,4-5H2
InChIKeyWLWFYYWPBIVXMO-UHFFFAOYSA-N
XLogP2.40
TPSA63.64 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.36
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

(4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(4-methylpyrimidin-5-yl)methanone
CID 124988703
(4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1-methylpyrazol-3-yl)methanone
CID 127245007
[4-(6-methylpyrazin-2-yl)piperidin-1-yl]-(1,3-oxazol-5-yl)methanone
CID 95846134
[(3S)-3-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-1-yl]-(1,3-oxazol-5-yl)methanone
CID 95846146
1,3-oxazol-5-yl-(3-pyrazin-2-ylpiperidin-1-yl)methanone
CID 110271238
4-benzyl-2-methyl-5-[1-(1,3-oxazole-5-carbonyl)piperidin-4-yl]-1,2,4-triazol-3-one
CID 56714567
1,4-diazepan-1-yl(1,3-oxazol-5-yl)methanone
CID 83617619
1,3-oxazol-5-yl-[4-(quinolin-3-ylmethyl)piperidin-1-yl]methanone
CID 118739871
[2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]-(1,3-oxazol-5-yl)methanone
CID 110112895
6-(4-pyridin-4-ylpiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 70721181
1,3-benzothiazol-2-yl-[4-(1,3-oxazol-2-yl)piperidin-1-yl]methanone
CID 126857975
morpholin-4-yl-[6-[(3S)-1-(1,3-oxazole-5-carbonyl)piperidin-3-yl]-2-pyridinyl]methanone
CID 125013177

Frequently Asked Questions

What is the IUPAC name of (4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone?
The IUPAC name of (4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone (CID 125014377) is (4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone.
What is the SMILES notation for (4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone?
The canonical SMILES for (4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone is O=C(c1cnco1)N1CCC(c2csc3nccn23)CC1.
What is the InChIKey of (4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone?
The InChIKey is WLWFYYWPBIVXMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2S/c19-13(12-7-15-9-20-12)17-4-1-10(2-5-17)11-8-21-14-16-3-6-18(11)14/h3,6-10H,1-2,4-5H2.
What are the key properties of (4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone?
(4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone has a molecular weight of 302.36 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (4-imidazo[2,1-b][1,3]thiazol-3-ylpiperidin-1-yl)-(1,3-oxazol-5-yl)methanone is sourced from PubChem (CID 125014377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).