N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide

C10H13N3OS — CID 6623495

IUPACN-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide
SMILESCCCC(=O)NCc1cn2ccsc2n1
InChIInChI=1S/C10H13N3OS/c1-2-3-9(14)11-6-8-7-13-4-5-15-10(13)12-8/h4-5,7H,2-3,6H2,1H3,(H,11,14)
InChIKeyFFKGHWJWSUHDTC-UHFFFAOYSA-N
MW223.30 g/mol
LogP1.81
Rot. Bonds4

About N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide

N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide (PubChem CID 6623495) has the molecular formula C10H13N3OS and a molecular weight of 223.30 g/mol. Its IUPAC name is N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide.

Molecular Properties

Compound NameN-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide
PubChem CID6623495
Molecular FormulaC10H13N3OS
Molecular Weight223.30 g/mol
Exact Mass223.08
IUPAC NameN-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide
SMILESCCCC(=O)NCc1cn2ccsc2n1
InChIInChI=1S/C10H13N3OS/c1-2-3-9(14)11-6-8-7-13-4-5-15-10(13)12-8/h4-5,7H,2-3,6H2,1H3,(H,11,14)
InChIKeyFFKGHWJWSUHDTC-UHFFFAOYSA-N
XLogP1.81
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide?
The IUPAC name of N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide (CID 6623495) is N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide.
What is the SMILES notation for N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide?
The canonical SMILES for N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide is CCCC(=O)NCc1cn2ccsc2n1.
What is the InChIKey of N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide?
The InChIKey is FFKGHWJWSUHDTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3OS/c1-2-3-9(14)11-6-8-7-13-4-5-15-10(13)12-8/h4-5,7H,2-3,6H2,1H3,(H,11,14).
What are the key properties of N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide?
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide has a molecular weight of 223.30 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butanamide is sourced from PubChem (CID 6623495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).