N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide

C11H8N4OS — CID 21452404

IUPACN-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide
SMILESO=C(Nc1nc2ccccc2[nH]1)c1ccns1
InChIInChI=1S/C11H8N4OS/c16-10(9-5-6-12-17-9)15-11-13-7-3-1-2-4-8(7)14-11/h1-6H,(H2,13,14,15,16)
InChIKeyHFXKKCGVTMFURZ-UHFFFAOYSA-N
MW244.28 g/mol
LogP2.27
Rot. Bonds2

About N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide

N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide (PubChem CID 21452404) has the molecular formula C11H8N4OS and a molecular weight of 244.28 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide
PubChem CID21452404
Molecular FormulaC11H8N4OS
Molecular Weight244.28 g/mol
Exact Mass244.04
IUPAC NameN-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide
SMILESO=C(Nc1nc2ccccc2[nH]1)c1ccns1
InChIInChI=1S/C11H8N4OS/c16-10(9-5-6-12-17-9)15-11-13-7-3-1-2-4-8(7)14-11/h1-6H,(H2,13,14,15,16)
InChIKeyHFXKKCGVTMFURZ-UHFFFAOYSA-N
XLogP2.27
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.28
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-benzimidazol-2-yl)-1H-benzimidazole-2-carboxamide
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N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide
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N-(1H-benzimidazol-2-yl)-5-bromo-4-methylthiophene-2-carboxamide
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N-(1H-benzimidazol-2-yl)-2-fluorobenzamide
CID 2166675
N-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydro-1H-1,3-diazepine-2-carboxamide
CID 91902407
2-amino-N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide
CID 63565075
N-(1H-benzimidazol-2-yl)-4-(carbamoylamino)benzamide
CID 2477191
5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide
CID 81316691
3-amino-N-(1H-benzimidazol-2-yl)benzamide
CID 62060005
N-(1H-benzimidazol-2-yl)-4-pyridin-4-yloxybenzamide
CID 11771861
N-(1H-benzimidazol-2-yl)-2-hydrazinylpyridine-3-carboxamide
CID 63563952
4-(1H-benzimidazol-2-ylcarbamoyl)pyridine-2-carboxylic acid
CID 115730029

Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide?
The IUPAC name of N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide (CID 21452404) is N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide.
What is the SMILES notation for N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide?
The canonical SMILES for N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide is O=C(Nc1nc2ccccc2[nH]1)c1ccns1.
What is the InChIKey of N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide?
The InChIKey is HFXKKCGVTMFURZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N4OS/c16-10(9-5-6-12-17-9)15-11-13-7-3-1-2-4-8(7)14-11/h1-6H,(H2,13,14,15,16).
What are the key properties of N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide?
N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide has a molecular weight of 244.28 g/mol, XLogP of 2.27, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-2-yl)-1,2-thiazole-5-carboxamide is sourced from PubChem (CID 21452404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).