2-(benzimidazol-1-yl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide

C19H16N4O2 — CID 121022671

IUPAC2-(benzimidazol-1-yl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide
SMILESO=C(Cn1cnc2ccccc21)NCc1cncc(-c2ccco2)c1
InChIInChI=1S/C19H16N4O2/c24-19(12-23-13-22-16-4-1-2-5-17(16)23)21-10-14-8-15(11-20-9-14)18-6-3-7-25-18/h1-9,11,13H,10,12H2,(H,21,24)
InChIKeyNPRJXPXYVKZOPU-UHFFFAOYSA-N
MW332.36 g/mol
LogP3.01
Rot. Bonds5

About 2-(benzimidazol-1-yl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide

2-(benzimidazol-1-yl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide (PubChem CID 121022671) has the molecular formula C19H16N4O2 and a molecular weight of 332.36 g/mol. Its IUPAC name is 2-(benzimidazol-1-yl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide.

Molecular Properties

Compound Name2-(benzimidazol-1-yl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide
PubChem CID121022671
Molecular FormulaC19H16N4O2
Molecular Weight332.36 g/mol
Exact Mass332.13
IUPAC Name2-(benzimidazol-1-yl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide
SMILESO=C(Cn1cnc2ccccc21)NCc1cncc(-c2ccco2)c1
InChIInChI=1S/C19H16N4O2/c24-19(12-23-13-22-16-4-1-2-5-17(16)23)21-10-14-8-15(11-20-9-14)18-6-3-7-25-18/h1-9,11,13H,10,12H2,(H,21,24)
InChIKeyNPRJXPXYVKZOPU-UHFFFAOYSA-N
XLogP3.01
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 53.01
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-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide?
The IUPAC name of 2-(benzimidazol-1-yl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide (CID 121022671) is 2-(benzimidazol-1-yl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide.
What is the SMILES notation for 2-(benzimidazol-1-yl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide?
The canonical SMILES for 2-(benzimidazol-1-yl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide is O=C(Cn1cnc2ccccc21)NCc1cncc(-c2ccco2)c1.
What is the InChIKey of 2-(benzimidazol-1-yl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide?
The InChIKey is NPRJXPXYVKZOPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O2/c24-19(12-23-13-22-16-4-1-2-5-17(16)23)21-10-14-8-15(11-20-9-14)18-6-3-7-25-18/h1-9,11,13H,10,12H2,(H,21,24).
What are the key properties of 2-(benzimidazol-1-yl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide?
2-(benzimidazol-1-yl)-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide has a molecular weight of 332.36 g/mol, XLogP of 3.01, 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-[[5-(furan-2-yl)-3-pyridinyl]methyl]acetamide is sourced from PubChem (CID 121022671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).