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

C11H9N3OS2 — CID 5310058

IUPACN-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)thiophene-2-carboxamide
SMILESO=C(NCc1cn2ccsc2n1)c1cccs1
InChIInChI=1S/C11H9N3OS2/c15-10(9-2-1-4-16-9)12-6-8-7-14-3-5-17-11(14)13-8/h1-5,7H,6H2,(H,12,15)
InChIKeyFBDBMZCVHXKJBN-UHFFFAOYSA-N
MW263.35 g/mol
LogP2.39
Rot. Bonds3

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

N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)thiophene-2-carboxamide (PubChem CID 5310058) has the molecular formula C11H9N3OS2 and a molecular weight of 263.35 g/mol. Its IUPAC name is N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)thiophene-2-carboxamide
PubChem CID5310058
Molecular FormulaC11H9N3OS2
Molecular Weight263.35 g/mol
Exact Mass263.02
IUPAC NameN-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)thiophene-2-carboxamide
SMILESO=C(NCc1cn2ccsc2n1)c1cccs1
InChIInChI=1S/C11H9N3OS2/c15-10(9-2-1-4-16-9)12-6-8-7-14-3-5-17-11(14)13-8/h1-5,7H,6H2,(H,12,15)
InChIKeyFBDBMZCVHXKJBN-UHFFFAOYSA-N
XLogP2.39
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.35
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)thiophene-2-carboxamide?
The IUPAC name of N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)thiophene-2-carboxamide (CID 5310058) is N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)thiophene-2-carboxamide?
The canonical SMILES for N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)thiophene-2-carboxamide is O=C(NCc1cn2ccsc2n1)c1cccs1.
What is the InChIKey of N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)thiophene-2-carboxamide?
The InChIKey is FBDBMZCVHXKJBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3OS2/c15-10(9-2-1-4-16-9)12-6-8-7-14-3-5-17-11(14)13-8/h1-5,7H,6H2,(H,12,15).
What are the key properties of N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)thiophene-2-carboxamide?
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)thiophene-2-carboxamide has a molecular weight of 263.35 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)thiophene-2-carboxamide is sourced from PubChem (CID 5310058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).