N,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide

C24H30N4O2 — CID 57393573

IUPACN,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide
SMILESCN(C)C(=O)CN1CCCC(c2nc3ccccc3n2CCOc2ccccc2)C1
InChIInChI=1S/C24H30N4O2/c1-26(2)23(29)18-27-14-8-9-19(17-27)24-25-21-12-6-7-13-22(21)28(24)15-16-30-20-10-4-3-5-11-20/h3-7,10-13,19H,8-9,14-18H2,1-2H3
InChIKeyZFUMGFQOKSXSLS-UHFFFAOYSA-N
MW406.53 g/mol
LogP3.38
Rot. Bonds7

About N,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide

N,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide (PubChem CID 57393573) has the molecular formula C24H30N4O2 and a molecular weight of 406.53 g/mol. Its IUPAC name is N,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide
PubChem CID57393573
Molecular FormulaC24H30N4O2
Molecular Weight406.53 g/mol
Exact Mass406.24
IUPAC NameN,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide
SMILESCN(C)C(=O)CN1CCCC(c2nc3ccccc3n2CCOc2ccccc2)C1
InChIInChI=1S/C24H30N4O2/c1-26(2)23(29)18-27-14-8-9-19(17-27)24-25-21-12-6-7-13-22(21)28(24)15-16-30-20-10-4-3-5-11-20/h3-7,10-13,19H,8-9,14-18H2,1-2H3
InChIKeyZFUMGFQOKSXSLS-UHFFFAOYSA-N
XLogP3.38
TPSA50.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.53
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide?
The IUPAC name of N,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide (CID 57393573) is N,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide is CN(C)C(=O)CN1CCCC(c2nc3ccccc3n2CCOc2ccccc2)C1.
What is the InChIKey of N,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide?
The InChIKey is ZFUMGFQOKSXSLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O2/c1-26(2)23(29)18-27-14-8-9-19(17-27)24-25-21-12-6-7-13-22(21)28(24)15-16-30-20-10-4-3-5-11-20/h3-7,10-13,19H,8-9,14-18H2,1-2H3.
What are the key properties of N,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide?
N,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide has a molecular weight of 406.53 g/mol, XLogP of 3.38, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[3-[1-(2-phenoxyethyl)benzimidazol-2-yl]piperidin-1-yl]acetamide is sourced from PubChem (CID 57393573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).