N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide

C14H16N4O2S — CID 70776640

IUPACN-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide
SMILESCCCc1cc(C(=O)NC(C)c2cn3ccsc3n2)no1
InChIInChI=1S/C14H16N4O2S/c1-3-4-10-7-11(17-20-10)13(19)15-9(2)12-8-18-5-6-21-14(18)16-12/h5-9H,3-4H2,1-2H3,(H,15,19)
InChIKeyJRDYFUZSZRPGHV-UHFFFAOYSA-N
MW304.38 g/mol
LogP2.83
Rot. Bonds5

About N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide

N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide (PubChem CID 70776640) has the molecular formula C14H16N4O2S and a molecular weight of 304.38 g/mol. Its IUPAC name is N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide
PubChem CID70776640
Molecular FormulaC14H16N4O2S
Molecular Weight304.38 g/mol
Exact Mass304.10
IUPAC NameN-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide
SMILESCCCc1cc(C(=O)NC(C)c2cn3ccsc3n2)no1
InChIInChI=1S/C14H16N4O2S/c1-3-4-10-7-11(17-20-10)13(19)15-9(2)12-8-18-5-6-21-14(18)16-12/h5-9H,3-4H2,1-2H3,(H,15,19)
InChIKeyJRDYFUZSZRPGHV-UHFFFAOYSA-N
XLogP2.83
TPSA72.43 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.38
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide (CID 70776640) is N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide is CCCc1cc(C(=O)NC(C)c2cn3ccsc3n2)no1.
What is the InChIKey of N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide?
The InChIKey is JRDYFUZSZRPGHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2S/c1-3-4-10-7-11(17-20-10)13(19)15-9(2)12-8-18-5-6-21-14(18)16-12/h5-9H,3-4H2,1-2H3,(H,15,19).
What are the key properties of N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide?
N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide has a molecular weight of 304.38 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-5-propyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 70776640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).