2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide

C17H17N3O2 — CID 974491

IUPAC2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide
SMILESCCn1c(COc2ccccc2C(N)=O)nc2ccccc21
InChIInChI=1S/C17H17N3O2/c1-2-20-14-9-5-4-8-13(14)19-16(20)11-22-15-10-6-3-7-12(15)17(18)21/h3-10H,2,11H2,1H3,(H2,18,21)
InChIKeyWPUASUPYUMVIOA-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.73
Rot. Bonds5

About 2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide

2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide (PubChem CID 974491) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is 2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide.

Molecular Properties

Compound Name2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide
PubChem CID974491
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide
SMILESCCn1c(COc2ccccc2C(N)=O)nc2ccccc21
InChIInChI=1S/C17H17N3O2/c1-2-20-14-9-5-4-8-13(14)19-16(20)11-22-15-10-6-3-7-12(15)17(18)21/h3-10H,2,11H2,1H3,(H2,18,21)
InChIKeyWPUASUPYUMVIOA-UHFFFAOYSA-N
XLogP2.73
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide?
The IUPAC name of 2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide (CID 974491) is 2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide.
What is the SMILES notation for 2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide?
The canonical SMILES for 2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide is CCn1c(COc2ccccc2C(N)=O)nc2ccccc21.
What is the InChIKey of 2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide?
The InChIKey is WPUASUPYUMVIOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-2-20-14-9-5-4-8-13(14)19-16(20)11-22-15-10-6-3-7-12(15)17(18)21/h3-10H,2,11H2,1H3,(H2,18,21).
What are the key properties of 2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide?
2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide has a molecular weight of 295.34 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-ethylbenzimidazol-2-yl)methoxy]benzamide is sourced from PubChem (CID 974491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).