[1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone

C16H21N5O3S — CID 56891270

IUPAC[1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone
SMILESCc1nc2sccn2c1C(=O)N1CCNCC1C(=O)N1CCOCC1
InChIInChI=1S/C16H21N5O3S/c1-11-13(21-6-9-25-16(21)18-11)15(23)20-3-2-17-10-12(20)14(22)19-4-7-24-8-5-19/h6,9,12,17H,2-5,7-8,10H2,1H3
InChIKeyNGIABGUVAVGLKA-UHFFFAOYSA-N
MW363.44 g/mol
LogP-0.02
Rot. Bonds2

About [1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone

[1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone (PubChem CID 56891270) has the molecular formula C16H21N5O3S and a molecular weight of 363.44 g/mol. Its IUPAC name is [1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone
PubChem CID56891270
Molecular FormulaC16H21N5O3S
Molecular Weight363.44 g/mol
Exact Mass363.14
IUPAC Name[1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone
SMILESCc1nc2sccn2c1C(=O)N1CCNCC1C(=O)N1CCOCC1
InChIInChI=1S/C16H21N5O3S/c1-11-13(21-6-9-25-16(21)18-11)15(23)20-3-2-17-10-12(20)14(22)19-4-7-24-8-5-19/h6,9,12,17H,2-5,7-8,10H2,1H3
InChIKeyNGIABGUVAVGLKA-UHFFFAOYSA-N
XLogP-0.02
TPSA79.18 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.44
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of [1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone (CID 56891270) is [1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone is Cc1nc2sccn2c1C(=O)N1CCNCC1C(=O)N1CCOCC1.
What is the InChIKey of [1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone?
The InChIKey is NGIABGUVAVGLKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O3S/c1-11-13(21-6-9-25-16(21)18-11)15(23)20-3-2-17-10-12(20)14(22)19-4-7-24-8-5-19/h6,9,12,17H,2-5,7-8,10H2,1H3.
What are the key properties of [1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone?
[1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone has a molecular weight of 363.44 g/mol, XLogP of -0.02, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbonyl)piperazin-2-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 56891270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).