N-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide

C18H14N4OS — CID 134795846

IUPACN-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide
SMILESCc1ccc(NC(=O)c2nc3sccn3c2-c2ccncc2)cc1
InChIInChI=1S/C18H14N4OS/c1-12-2-4-14(5-3-12)20-17(23)15-16(13-6-8-19-9-7-13)22-10-11-24-18(22)21-15/h2-11H,1H3,(H,20,23)
InChIKeyZSBUSJPEWROYCE-UHFFFAOYSA-N
MW334.40 g/mol
LogP4.02
Rot. Bonds3

About N-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide

N-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide (PubChem CID 134795846) has the molecular formula C18H14N4OS and a molecular weight of 334.40 g/mol. Its IUPAC name is N-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide
PubChem CID134795846
Molecular FormulaC18H14N4OS
Molecular Weight334.40 g/mol
Exact Mass334.09
IUPAC NameN-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide
SMILESCc1ccc(NC(=O)c2nc3sccn3c2-c2ccncc2)cc1
InChIInChI=1S/C18H14N4OS/c1-12-2-4-14(5-3-12)20-17(23)15-16(13-6-8-19-9-7-13)22-10-11-24-18(22)21-15/h2-11H,1H3,(H,20,23)
InChIKeyZSBUSJPEWROYCE-UHFFFAOYSA-N
XLogP4.02
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
The IUPAC name of N-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide (CID 134795846) is N-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide.
What is the SMILES notation for N-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
The canonical SMILES for N-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide is Cc1ccc(NC(=O)c2nc3sccn3c2-c2ccncc2)cc1.
What is the InChIKey of N-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
The InChIKey is ZSBUSJPEWROYCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4OS/c1-12-2-4-14(5-3-12)20-17(23)15-16(13-6-8-19-9-7-13)22-10-11-24-18(22)21-15/h2-11H,1H3,(H,20,23).
What are the key properties of N-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
N-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide has a molecular weight of 334.40 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-6-carboxamide is sourced from PubChem (CID 134795846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).