N-(1,3-thiazol-2-yl)thiophene-2-carboxamide

C8H6N2OS2 — CID 573863

IUPACN-(1,3-thiazol-2-yl)thiophene-2-carboxamide
SMILESO=C(Nc1nccs1)c1cccs1
InChIInChI=1S/C8H6N2OS2/c11-7(6-2-1-4-12-6)10-8-9-3-5-13-8/h1-5H,(H,9,10,11)
InChIKeyZJMXIXDFMLCWHZ-UHFFFAOYSA-N
MW210.28 g/mol
LogP2.46
Rot. Bonds2

About N-(1,3-thiazol-2-yl)thiophene-2-carboxamide

N-(1,3-thiazol-2-yl)thiophene-2-carboxamide (PubChem CID 573863) has the molecular formula C8H6N2OS2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-(1,3-thiazol-2-yl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(1,3-thiazol-2-yl)thiophene-2-carboxamide
PubChem CID573863
Molecular FormulaC8H6N2OS2
Molecular Weight210.28 g/mol
Exact Mass209.99
IUPAC NameN-(1,3-thiazol-2-yl)thiophene-2-carboxamide
SMILESO=C(Nc1nccs1)c1cccs1
InChIInChI=1S/C8H6N2OS2/c11-7(6-2-1-4-12-6)10-8-9-3-5-13-8/h1-5H,(H,9,10,11)
InChIKeyZJMXIXDFMLCWHZ-UHFFFAOYSA-N
XLogP2.46
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1,3-thiazol-2-yl)thiophene-2-carboxamide?
The IUPAC name of N-(1,3-thiazol-2-yl)thiophene-2-carboxamide (CID 573863) is N-(1,3-thiazol-2-yl)thiophene-2-carboxamide.
What is the SMILES notation for N-(1,3-thiazol-2-yl)thiophene-2-carboxamide?
The canonical SMILES for N-(1,3-thiazol-2-yl)thiophene-2-carboxamide is O=C(Nc1nccs1)c1cccs1.
What is the InChIKey of N-(1,3-thiazol-2-yl)thiophene-2-carboxamide?
The InChIKey is ZJMXIXDFMLCWHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2OS2/c11-7(6-2-1-4-12-6)10-8-9-3-5-13-8/h1-5H,(H,9,10,11).
What are the key properties of N-(1,3-thiazol-2-yl)thiophene-2-carboxamide?
N-(1,3-thiazol-2-yl)thiophene-2-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-thiazol-2-yl)thiophene-2-carboxamide is sourced from PubChem (CID 573863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).