N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide

C26H34N4O3 — CID 24622698

IUPACN-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
SMILESCC1CN(C(C)(C)CNC(=O)Cn2c(COc3ccccc3)nc3ccccc32)CC(C)O1
InChIInChI=1S/C26H34N4O3/c1-19-14-29(15-20(2)33-19)26(3,4)18-27-25(31)16-30-23-13-9-8-12-22(23)28-24(30)17-32-21-10-6-5-7-11-21/h5-13,19-20H,14-18H2,1-4H3,(H,27,31)
InChIKeyOBFTVNZWCHISPH-UHFFFAOYSA-N
MW450.58 g/mol
LogP3.62
Rot. Bonds8

About N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide

N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide (PubChem CID 24622698) has the molecular formula C26H34N4O3 and a molecular weight of 450.58 g/mol. Its IUPAC name is N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
PubChem CID24622698
Molecular FormulaC26H34N4O3
Molecular Weight450.58 g/mol
Exact Mass450.26
IUPAC NameN-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
SMILESCC1CN(C(C)(C)CNC(=O)Cn2c(COc3ccccc3)nc3ccccc32)CC(C)O1
InChIInChI=1S/C26H34N4O3/c1-19-14-29(15-20(2)33-19)26(3,4)18-27-25(31)16-30-23-13-9-8-12-22(23)28-24(30)17-32-21-10-6-5-7-11-21/h5-13,19-20H,14-18H2,1-4H3,(H,27,31)
InChIKeyOBFTVNZWCHISPH-UHFFFAOYSA-N
XLogP3.62
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.58
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-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

Related Compounds

N-(2-methoxyethyl)-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 35805150
N-(1-amino-2-cyclopropylpropan-2-yl)-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide;dihydrochloride
CID 119573300
N-[2-(2-methylbenzimidazol-1-yl)ethyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 24583706
N-[3-(2-methylbenzimidazol-1-yl)propyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 112767743
2-(2-ethylbenzimidazol-1-yl)-N-[[2-(phenoxymethyl)phenyl]methyl]acetamide
CID 17417716
2-[2-(phenoxymethyl)benzimidazol-1-yl]-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide
CID 35805286
2-cyclopropyl-2-[[2-[2-(phenoxymethyl)benzimidazol-1-yl]acetyl]amino]acetic acid
CID 119213222
N-(3-methoxyphenyl)-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 3597096
1-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]ethanone
CID 37334061
N'-[2-[2-(phenoxymethyl)benzimidazol-1-yl]acetyl]-1,3-benzodioxole-5-carbohydrazide
CID 42160417
N-[(3-methoxyphenyl)methyl]-2-[2-[(4-methylphenoxy)methyl]benzimidazol-1-yl]acetamide
CID 134051104
2-[2-[(4-chlorophenoxy)methyl]benzimidazol-1-yl]-N-(2-hydroxypropyl)acetamide
CID 78857564

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide?
The IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide (CID 24622698) is N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide is CC1CN(C(C)(C)CNC(=O)Cn2c(COc3ccccc3)nc3ccccc32)CC(C)O1.
What is the InChIKey of N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide?
The InChIKey is OBFTVNZWCHISPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H34N4O3/c1-19-14-29(15-20(2)33-19)26(3,4)18-27-25(31)16-30-23-13-9-8-12-22(23)28-24(30)17-32-21-10-6-5-7-11-21/h5-13,19-20H,14-18H2,1-4H3,(H,27,31).
What are the key properties of N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide?
N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide has a molecular weight of 450.58 g/mol, XLogP of 3.62, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 24622698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).