N-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide

C7H5N3OS2 — CID 130841000

IUPACN-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide
SMILESO=C(Nc1nccs1)c1cncs1
InChIInChI=1S/C7H5N3OS2/c11-6(5-3-8-4-13-5)10-7-9-1-2-12-7/h1-4H,(H,9,10,11)
InChIKeyGLLXJGCACOVOOW-UHFFFAOYSA-N
MW211.27 g/mol
LogP1.85
Rot. Bonds2

About N-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide

N-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide (PubChem CID 130841000) has the molecular formula C7H5N3OS2 and a molecular weight of 211.27 g/mol. Its IUPAC name is N-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide
PubChem CID130841000
Molecular FormulaC7H5N3OS2
Molecular Weight211.27 g/mol
Exact Mass210.99
IUPAC NameN-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide
SMILESO=C(Nc1nccs1)c1cncs1
InChIInChI=1S/C7H5N3OS2/c11-6(5-3-8-4-13-5)10-7-9-1-2-12-7/h1-4H,(H,9,10,11)
InChIKeyGLLXJGCACOVOOW-UHFFFAOYSA-N
XLogP1.85
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.27
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1,3-thiazol-2-yl)-2-(1,3-thiazol-5-yl)pyridine-4-carboxamide
CID 110131633
N'-(1,3-thiazole-5-carbonyl)-1,3-thiazole-5-carbohydrazide
CID 139226744
N-(1,3-thiazol-2-yl)benzamide;hydrochloride
CID 141066064
molecular hydrogen;N-(1,3-thiazol-2-yl)acetamide
CID 143921220
1,3-thiazol-2-ylurea;hydrochloride
CID 118455578
5-methyl-N-(1,3-thiazol-2-yl)-1H-imidazole-4-carboxamide
CID 110684009
N-(4-fluorophenyl)-1,3-thiazole-5-carboxamide
CID 5299224
3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 61090146
N-(1,3-thiazol-2-yl)isoquinoline-6-carboxamide
CID 110485084
N-(1,3-thiazol-2-yl)-4-thiophen-2-ylthiophene-2-carboxamide
CID 71690073
(1,3-thiazole-5-carbonylamino)carbamic acid
CID 123379520
5-(methylamino)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide
CID 104639863

Frequently Asked Questions

What is the IUPAC name of N-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide?
The IUPAC name of N-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide (CID 130841000) is N-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide is O=C(Nc1nccs1)c1cncs1.
What is the InChIKey of N-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide?
The InChIKey is GLLXJGCACOVOOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5N3OS2/c11-6(5-3-8-4-13-5)10-7-9-1-2-12-7/h1-4H,(H,9,10,11).
What are the key properties of N-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide?
N-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide has a molecular weight of 211.27 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 130841000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).