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

C11H7ClN4OS — CID 4166742

IUPAC6-chloro-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESO=C(Nc1ccncc1)c1c(Cl)nc2sccn12
InChIInChI=1S/C11H7ClN4OS/c12-9-8(16-5-6-18-11(16)15-9)10(17)14-7-1-3-13-4-2-7/h1-6H,(H,13,14,17)
InChIKeyMFOQBWFJSVMWKI-UHFFFAOYSA-N
MW278.72 g/mol
LogP2.70
Rot. Bonds2

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

6-chloro-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-5-carboxamide (PubChem CID 4166742) has the molecular formula C11H7ClN4OS and a molecular weight of 278.72 g/mol. Its IUPAC name is 6-chloro-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound Name6-chloro-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-5-carboxamide
PubChem CID4166742
Molecular FormulaC11H7ClN4OS
Molecular Weight278.72 g/mol
Exact Mass278.00
IUPAC Name6-chloro-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESO=C(Nc1ccncc1)c1c(Cl)nc2sccn12
InChIInChI=1S/C11H7ClN4OS/c12-9-8(16-5-6-18-11(16)15-9)10(17)14-7-1-3-13-4-2-7/h1-6H,(H,13,14,17)
InChIKeyMFOQBWFJSVMWKI-UHFFFAOYSA-N
XLogP2.70
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.72
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-5-carboxamide?
The IUPAC name of 6-chloro-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-5-carboxamide (CID 4166742) is 6-chloro-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-5-carboxamide.
What is the SMILES notation for 6-chloro-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-5-carboxamide?
The canonical SMILES for 6-chloro-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-5-carboxamide is O=C(Nc1ccncc1)c1c(Cl)nc2sccn12.
What is the InChIKey of 6-chloro-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-5-carboxamide?
The InChIKey is MFOQBWFJSVMWKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClN4OS/c12-9-8(16-5-6-18-11(16)15-9)10(17)14-7-1-3-13-4-2-7/h1-6H,(H,13,14,17).
What are the key properties of 6-chloro-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-5-carboxamide?
6-chloro-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-5-carboxamide has a molecular weight of 278.72 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-pyridin-4-ylimidazo[2,1-b][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 4166742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).