2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide

C21H23N3O2 — CID 110711147

IUPAC2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide
SMILESCc1cccc(OCC(=O)NCCc2cn(-c3ccccc3)c(C)n2)c1
InChIInChI=1S/C21H23N3O2/c1-16-7-6-10-20(13-16)26-15-21(25)22-12-11-18-14-24(17(2)23-18)19-8-4-3-5-9-19/h3-10,13-14H,11-12,15H2,1-2H3,(H,22,25)
InChIKeySCAVYEHYHZYFMI-UHFFFAOYSA-N
MW349.43 g/mol
LogP3.23
Rot. Bonds7

About 2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide

2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide (PubChem CID 110711147) has the molecular formula C21H23N3O2 and a molecular weight of 349.43 g/mol. Its IUPAC name is 2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide
PubChem CID110711147
Molecular FormulaC21H23N3O2
Molecular Weight349.43 g/mol
Exact Mass349.18
IUPAC Name2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide
SMILESCc1cccc(OCC(=O)NCCc2cn(-c3ccccc3)c(C)n2)c1
InChIInChI=1S/C21H23N3O2/c1-16-7-6-10-20(13-16)26-15-21(25)22-12-11-18-14-24(17(2)23-18)19-8-4-3-5-9-19/h3-10,13-14H,11-12,15H2,1-2H3,(H,22,25)
InChIKeySCAVYEHYHZYFMI-UHFFFAOYSA-N
XLogP3.23
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]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

2-(3-methylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide
CID 4784838
N-[2-(7-methylimidazo[1,2-a]pyridin-2-yl)ethyl]-2-phenoxyacetamide
CID 7150752
2-(3-methylphenoxy)-N-[3-(3-methylphenoxy)propyl]acetamide
CID 24533364
N-[2-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]-2-phenoxyacetamide
CID 110321314
N-[2-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide
CID 8935101
N-(3-aminobutyl)-2-(3-methylphenoxy)acetamide;hydrochloride
CID 119497988
N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-(3-methylphenoxy)acetamide
CID 90537660
N-[2-[[2-(3-methylphenoxy)acetyl]amino]ethyl]pyridine-2-carboxamide
CID 2991309
N-hexadecyl-2-(3-methylphenoxy)acetamide
CID 3324097
3-[2-[[2-(3-methylphenoxy)acetyl]amino]ethyldisulfanyl]propanoic acid
CID 166422763
N-[2-(furan-2-yl)ethyl]-2-(3-methylphenoxy)acetamide
CID 110733552
2-(3-methylphenoxy)-N-(2-phenylethylcarbamothioyl)acetamide
CID 4659062

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide?
The IUPAC name of 2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide (CID 110711147) is 2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide.
What is the SMILES notation for 2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide?
The canonical SMILES for 2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide is Cc1cccc(OCC(=O)NCCc2cn(-c3ccccc3)c(C)n2)c1.
What is the InChIKey of 2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide?
The InChIKey is SCAVYEHYHZYFMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O2/c1-16-7-6-10-20(13-16)26-15-21(25)22-12-11-18-14-24(17(2)23-18)19-8-4-3-5-9-19/h3-10,13-14H,11-12,15H2,1-2H3,(H,22,25).
What are the key properties of 2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide?
2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide has a molecular weight of 349.43 g/mol, XLogP of 3.23, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenoxy)-N-[2-(2-methyl-1-phenylimidazol-4-yl)ethyl]acetamide is sourced from PubChem (CID 110711147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).