3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide

C20H24N4O2S — CID 5310220

IUPAC3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide
SMILESCc1c(C(=O)NCCCN2CCOCC2)sc2nc(-c3ccccc3)cn12
InChIInChI=1S/C20H24N4O2S/c1-15-18(19(25)21-8-5-9-23-10-12-26-13-11-23)27-20-22-17(14-24(15)20)16-6-3-2-4-7-16/h2-4,6-7,14H,5,8-13H2,1H3,(H,21,25)
InChIKeyBGQKVIMWPQLTFN-UHFFFAOYSA-N
MW384.51 g/mol
LogP2.82
Rot. Bonds6

About 3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide

3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide (PubChem CID 5310220) has the molecular formula C20H24N4O2S and a molecular weight of 384.51 g/mol. Its IUPAC name is 3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide
PubChem CID5310220
Molecular FormulaC20H24N4O2S
Molecular Weight384.51 g/mol
Exact Mass384.16
IUPAC Name3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide
SMILESCc1c(C(=O)NCCCN2CCOCC2)sc2nc(-c3ccccc3)cn12
InChIInChI=1S/C20H24N4O2S/c1-15-18(19(25)21-8-5-9-23-10-12-26-13-11-23)27-20-22-17(14-24(15)20)16-6-3-2-4-7-16/h2-4,6-7,14H,5,8-13H2,1H3,(H,21,25)
InChIKeyBGQKVIMWPQLTFN-UHFFFAOYSA-N
XLogP2.82
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.51
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Srt-2104
CID 25108829
N-(4-(diethylamino)phenyl)-3-methyl-6-phenylimidazo[2,1-b]thiazole-2-carboxamide
CID 16029593
6-(4-fluorophenyl)-N,3-dimethyl-N-phenylimidazo[2,1-b]thiazole-2-carboxamide
CID 16029632
Imidazo[2,1-b]thiazole-5-carboxamide,6-methyl-N-[(3R)-1-[[2-methyl-5-(3-methylphenyl)-4-thiazolyl]carbonyl]-3-piperidinyl]-
CID 24808511
2-(3-benzyl-2-oxoimidazolidin-1-yl)-4-methyl-N-(pyridin-2-ylmethyl)thiazole-5-carboxamide
CID 25094875
2-(3-(4-fluorobenzyl)-2-oxoimidazolidin-1-yl)-4-methyl-N-(pyridin-3-ylmethyl)thiazole-5-carboxamide
CID 25095149
4-Methyl-2-phenyl-thiazole-5-carboxylic acid (6-morpholin-4-yl-pyridin-3-yl)-amide
CID 36145850
2-(3-(cyclohexylmethyl)-2-oxoimidazolidin-1-yl)-4-methyl-N-(pyridin-3-ylmethyl)thiazole-5-carboxamide
CID 59481196
2-(3-benzyl-2-oxoimidazolidin-1-yl)-4-methyl-N-(pyridin-4-ylmethyl)thiazole-5-carboxamide
CID 59481229
2-(3-(4-fluorobenzyl)-2-oxoimidazolidin-1-yl)-4-methyl-N-(pyridin-2-ylmethyl)thiazole-5-carboxamide
CID 59481280
2-(1-(4-fluorobenzyl)-5-oxo-1H-1,2,4-triazol-4(5H)-yl)-4-methyl-N-((1-methyl-1H-imidazol-4-yl)methyl)thiazole-5-carboxamide
CID 59481293
2-(3-benzyl-2-oxoimidazolidin-1-yl)-4-methyl-N-(pyridin-3-ylmethyl)thiazole-5-carboxamide
CID 59481303

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide?
The IUPAC name of 3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide (CID 5310220) is 3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide?
The canonical SMILES for 3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide is Cc1c(C(=O)NCCCN2CCOCC2)sc2nc(-c3ccccc3)cn12.
What is the InChIKey of 3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide?
The InChIKey is BGQKVIMWPQLTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2S/c1-15-18(19(25)21-8-5-9-23-10-12-26-13-11-23)27-20-22-17(14-24(15)20)16-6-3-2-4-7-16/h2-4,6-7,14H,5,8-13H2,1H3,(H,21,25).
What are the key properties of 3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide?
3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide has a molecular weight of 384.51 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(3-morpholin-4-ylpropyl)-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide is sourced from PubChem (CID 5310220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).