N-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide

C20H23N3O2 — CID 3647274

IUPACN-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide
SMILESCCN(Cc1ccccc1)C(=O)Cn1c(C(C)O)nc2ccccc21
InChIInChI=1S/C20H23N3O2/c1-3-22(13-16-9-5-4-6-10-16)19(25)14-23-18-12-8-7-11-17(18)21-20(23)15(2)24/h4-12,15,24H,3,13-14H2,1-2H3
InChIKeyAGICZZATRJZWPF-UHFFFAOYSA-N
MW337.42 g/mol
LogP3.14
Rot. Bonds6

About N-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide

N-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide (PubChem CID 3647274) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide
PubChem CID3647274
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide
SMILESCCN(Cc1ccccc1)C(=O)Cn1c(C(C)O)nc2ccccc21
InChIInChI=1S/C20H23N3O2/c1-3-22(13-16-9-5-4-6-10-16)19(25)14-23-18-12-8-7-11-17(18)21-20(23)15(2)24/h4-12,15,24H,3,13-14H2,1-2H3
InChIKeyAGICZZATRJZWPF-UHFFFAOYSA-N
XLogP3.14
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide?
The IUPAC name of N-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide (CID 3647274) is N-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide is CCN(Cc1ccccc1)C(=O)Cn1c(C(C)O)nc2ccccc21.
What is the InChIKey of N-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide?
The InChIKey is AGICZZATRJZWPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-3-22(13-16-9-5-4-6-10-16)19(25)14-23-18-12-8-7-11-17(18)21-20(23)15(2)24/h4-12,15,24H,3,13-14H2,1-2H3.
What are the key properties of N-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide?
N-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide has a molecular weight of 337.42 g/mol, XLogP of 3.14, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethyl-2-[2-(1-hydroxyethyl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 3647274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).