2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide

C14H14N4OS — CID 110773212

IUPAC2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide
SMILESCc1nc2cc(CC(=O)Nc3nccs3)ccc2n1C
InChIInChI=1S/C14H14N4OS/c1-9-16-11-7-10(3-4-12(11)18(9)2)8-13(19)17-14-15-5-6-20-14/h3-7H,8H2,1-2H3,(H,15,17,19)
InChIKeyCDJDYOJFENZBPC-UHFFFAOYSA-N
MW286.36 g/mol
LogP2.52
Rot. Bonds3

About 2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide

2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 110773212) has the molecular formula C14H14N4OS and a molecular weight of 286.36 g/mol. Its IUPAC name is 2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide
PubChem CID110773212
Molecular FormulaC14H14N4OS
Molecular Weight286.36 g/mol
Exact Mass286.09
IUPAC Name2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide
SMILESCc1nc2cc(CC(=O)Nc3nccs3)ccc2n1C
InChIInChI=1S/C14H14N4OS/c1-9-16-11-7-10(3-4-12(11)18(9)2)8-13(19)17-14-15-5-6-20-14/h3-7H,8H2,1-2H3,(H,15,17,19)
InChIKeyCDJDYOJFENZBPC-UHFFFAOYSA-N
XLogP2.52
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1,2-dimethylbenzimidazol-5-yl)-N-(3-methylphenyl)acetamide
CID 110773176
2-(3-methylphenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 6468138
2-(1,2-dimethylbenzimidazol-5-yl)-N-[(4-methylphenyl)methyl]acetamide
CID 110773124
2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 770967
2-(3,4-dimethoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 648788
2-(1,2-dimethylbenzimidazol-5-yl)-N-(1H-indazol-6-yl)acetamide
CID 110773214
2-(4-bromophenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 669868
2-(3-chlorophenyl)-N-(1,2-dimethylbenzimidazol-5-yl)acetamide
CID 110779237
1-benzyl-3-[(1,2-dimethylbenzimidazol-5-yl)methyl]urea
CID 110775488
N-(1,2-dimethylbenzimidazol-5-yl)-2-(5-methyl-1H-pyrrol-3-yl)acetamide
CID 112527544
2-(2,5-dimethylpyrrol-1-yl)-N-(1,3-thiazol-2-yl)acetamide
CID 110688880
methyl 2-[(1,2-dimethylbenzimidazol-5-yl)methylamino]-2-oxoacetate
CID 115142414

Frequently Asked Questions

What is the IUPAC name of 2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide (CID 110773212) is 2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide is Cc1nc2cc(CC(=O)Nc3nccs3)ccc2n1C.
What is the InChIKey of 2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is CDJDYOJFENZBPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4OS/c1-9-16-11-7-10(3-4-12(11)18(9)2)8-13(19)17-14-15-5-6-20-14/h3-7H,8H2,1-2H3,(H,15,17,19).
What are the key properties of 2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide?
2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 286.36 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-dimethylbenzimidazol-5-yl)-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 110773212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).