2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide

C14H14N4OS — CID 110445560

IUPAC2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
SMILESO=C(Cn1cnc2ccccc21)NCCc1nccs1
InChIInChI=1S/C14H14N4OS/c19-13(15-6-5-14-16-7-8-20-14)9-18-10-17-11-3-1-2-4-12(11)18/h1-4,7-8,10H,5-6,9H2,(H,15,19)
InChIKeyRWPKLKCBOYDCIV-UHFFFAOYSA-N
MW286.36 g/mol
LogP1.85
Rot. Bonds5

About 2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide

2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide (PubChem CID 110445560) has the molecular formula C14H14N4OS and a molecular weight of 286.36 g/mol. Its IUPAC name is 2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
PubChem CID110445560
Molecular FormulaC14H14N4OS
Molecular Weight286.36 g/mol
Exact Mass286.09
IUPAC Name2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
SMILESO=C(Cn1cnc2ccccc21)NCCc1nccs1
InChIInChI=1S/C14H14N4OS/c19-13(15-6-5-14-16-7-8-20-14)9-18-10-17-11-3-1-2-4-12(11)18/h1-4,7-8,10H,5-6,9H2,(H,15,19)
InChIKeyRWPKLKCBOYDCIV-UHFFFAOYSA-N
XLogP1.85
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
The IUPAC name of 2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide (CID 110445560) is 2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide is O=C(Cn1cnc2ccccc21)NCCc1nccs1.
What is the InChIKey of 2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
The InChIKey is RWPKLKCBOYDCIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4OS/c19-13(15-6-5-14-16-7-8-20-14)9-18-10-17-11-3-1-2-4-12(11)18/h1-4,7-8,10H,5-6,9H2,(H,15,19).
What are the key properties of 2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide has a molecular weight of 286.36 g/mol, XLogP of 1.85, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzimidazol-1-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 110445560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).