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

C12H11N3OS2 — CID 5310147

IUPACN-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide
SMILESO=C(NCCc1cn2ccsc2n1)c1cccs1
InChIInChI=1S/C12H11N3OS2/c16-11(10-2-1-6-17-10)13-4-3-9-8-15-5-7-18-12(15)14-9/h1-2,5-8H,3-4H2,(H,13,16)
InChIKeyPNMIMKAKTCPDTA-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.43
Rot. Bonds4

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

N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide (PubChem CID 5310147) has the molecular formula C12H11N3OS2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide
PubChem CID5310147
Molecular FormulaC12H11N3OS2
Molecular Weight277.37 g/mol
Exact Mass277.03
IUPAC NameN-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide
SMILESO=C(NCCc1cn2ccsc2n1)c1cccs1
InChIInChI=1S/C12H11N3OS2/c16-11(10-2-1-6-17-10)13-4-3-9-8-15-5-7-18-12(15)14-9/h1-2,5-8H,3-4H2,(H,13,16)
InChIKeyPNMIMKAKTCPDTA-UHFFFAOYSA-N
XLogP2.43
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(2-imidazo[2,1-b][1,3]thiazol-6-ylethylamino)-2-oxoethyl]benzamide
CID 110661562
1-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-propylurea
CID 110661644
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-4-sulfamoylbenzamide
CID 77083416
2-ethoxy-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide
CID 7150814
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-2,3-dimethylquinoxaline-6-carboxamide
CID 110661566
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-pyridin-3-ylpropanamide
CID 90652526
1-cyclopentyl-3-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)urea
CID 110661647
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 55560269
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(1-thiophen-2-ylethylideneamino)acetamide
CID 5143876
N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide
CID 5310230
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-1-methyl-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 118776725
2-(2,4-dichlorophenoxy)-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide
CID 110661578

Frequently Asked Questions

What is the IUPAC name of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide?
The IUPAC name of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide (CID 5310147) is N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide is O=C(NCCc1cn2ccsc2n1)c1cccs1.
What is the InChIKey of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide?
The InChIKey is PNMIMKAKTCPDTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3OS2/c16-11(10-2-1-6-17-10)13-4-3-9-8-15-5-7-18-12(15)14-9/h1-2,5-8H,3-4H2,(H,13,16).
What are the key properties of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide?
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide is sourced from PubChem (CID 5310147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).