2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide

C20H24N4O2 — CID 46970461

IUPAC2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide
SMILESCCn1c(NC(=O)c2ccccc2OCCN(C)C)nc2ccccc21
InChIInChI=1S/C20H24N4O2/c1-4-24-17-11-7-6-10-16(17)21-20(24)22-19(25)15-9-5-8-12-18(15)26-14-13-23(2)3/h5-12H,4,13-14H2,1-3H3,(H,21,22,25)
InChIKeyLPTAXDXQYIZXEX-UHFFFAOYSA-N
MW352.44 g/mol
LogP3.25
Rot. Bonds7

About 2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide

2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide (PubChem CID 46970461) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide
PubChem CID46970461
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC Name2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide
SMILESCCn1c(NC(=O)c2ccccc2OCCN(C)C)nc2ccccc21
InChIInChI=1S/C20H24N4O2/c1-4-24-17-11-7-6-10-16(17)21-20(24)22-19(25)15-9-5-8-12-18(15)26-14-13-23(2)3/h5-12H,4,13-14H2,1-3H3,(H,21,22,25)
InChIKeyLPTAXDXQYIZXEX-UHFFFAOYSA-N
XLogP3.25
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide?
The IUPAC name of 2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide (CID 46970461) is 2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide.
What is the SMILES notation for 2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide?
The canonical SMILES for 2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide is CCn1c(NC(=O)c2ccccc2OCCN(C)C)nc2ccccc21.
What is the InChIKey of 2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide?
The InChIKey is LPTAXDXQYIZXEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c1-4-24-17-11-7-6-10-16(17)21-20(24)22-19(25)15-9-5-8-12-18(15)26-14-13-23(2)3/h5-12H,4,13-14H2,1-3H3,(H,21,22,25).
What are the key properties of 2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide?
2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide has a molecular weight of 352.44 g/mol, XLogP of 3.25, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide is sourced from PubChem (CID 46970461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).