N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide

C13H14N4O2S — CID 70783173

IUPACN-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide
SMILESCCc1cc(CN(C)C(=O)c2cn3ccsc3n2)on1
InChIInChI=1S/C13H14N4O2S/c1-3-9-6-10(19-15-9)7-16(2)12(18)11-8-17-4-5-20-13(17)14-11/h4-6,8H,3,7H2,1-2H3
InChIKeyHVHFQIOCDFCMAY-UHFFFAOYSA-N
MW290.35 g/mol
LogP2.22
Rot. Bonds4

About N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide

N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide (PubChem CID 70783173) has the molecular formula C13H14N4O2S and a molecular weight of 290.35 g/mol. Its IUPAC name is N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide.

Molecular Properties

Compound NameN-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide
PubChem CID70783173
Molecular FormulaC13H14N4O2S
Molecular Weight290.35 g/mol
Exact Mass290.08
IUPAC NameN-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide
SMILESCCc1cc(CN(C)C(=O)c2cn3ccsc3n2)on1
InChIInChI=1S/C13H14N4O2S/c1-3-9-6-10(19-15-9)7-16(2)12(18)11-8-17-4-5-20-13(17)14-11/h4-6,8H,3,7H2,1-2H3
InChIKeyHVHFQIOCDFCMAY-UHFFFAOYSA-N
XLogP2.22
TPSA63.64 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.35
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
The IUPAC name of N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide (CID 70783173) is N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide.
What is the SMILES notation for N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
The canonical SMILES for N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide is CCc1cc(CN(C)C(=O)c2cn3ccsc3n2)on1.
What is the InChIKey of N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
The InChIKey is HVHFQIOCDFCMAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2S/c1-3-9-6-10(19-15-9)7-16(2)12(18)11-8-17-4-5-20-13(17)14-11/h4-6,8H,3,7H2,1-2H3.
What are the key properties of N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide has a molecular weight of 290.35 g/mol, XLogP of 2.22, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide is sourced from PubChem (CID 70783173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).