2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide

C32H29N3O3 — CID 22095117

IUPAC2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide
SMILESCc1ccc(OC(C)C(=O)Nc2ccccc2-c2[nH]c(-c3ccccc3)nc2Oc2ccccc2)c(C)c1
InChIInChI=1S/C32H29N3O3/c1-21-18-19-28(22(2)20-21)37-23(3)31(36)33-27-17-11-10-16-26(27)29-32(38-25-14-8-5-9-15-25)35-30(34-29)24-12-6-4-7-13-24/h4-20,23H,1-3H3,(H,33,36)(H,34,35)
InChIKeyOGMYPPZLKKUULL-UHFFFAOYSA-N
MW503.60 g/mol
LogP7.56
Rot. Bonds8

About 2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide

2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide (PubChem CID 22095117) has the molecular formula C32H29N3O3 and a molecular weight of 503.60 g/mol. Its IUPAC name is 2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide.

Molecular Properties

Compound Name2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide
PubChem CID22095117
Molecular FormulaC32H29N3O3
Molecular Weight503.60 g/mol
Exact Mass503.22
IUPAC Name2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide
SMILESCc1ccc(OC(C)C(=O)Nc2ccccc2-c2[nH]c(-c3ccccc3)nc2Oc2ccccc2)c(C)c1
InChIInChI=1S/C32H29N3O3/c1-21-18-19-28(22(2)20-21)37-23(3)31(36)33-27-17-11-10-16-26(27)29-32(38-25-14-8-5-9-15-25)35-30(34-29)24-12-6-4-7-13-24/h4-20,23H,1-3H3,(H,33,36)(H,34,35)
InChIKeyOGMYPPZLKKUULL-UHFFFAOYSA-N
XLogP7.56
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500503.60
LogP ≤ 57.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide 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

5-chloro-4-(4-chlorophenyl)-2-[4-[1-(2,4-dimethylphenyl)propyl]phenyl]-1H-pyrrole-3-carbonitrile;N-[4-chloro-1-[5-[2-[2-(2,4-dimethylphenoxy)propanoylamino]phenyl]-4-phenoxy-1H-imidazol-2-yl]-3-phenylpyrazol-5-yl]benzamide;2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide;formaldehyde
CID 91321569
(2S)-2-(2,5-dimethylphenoxy)-N-(2-phenylphenyl)propanamide
CID 40866622
(2S)-N-(5-chloro-2-phenoxyphenyl)-2-(2,4-dimethylphenoxy)propanamide
CID 9172968
N-(2-aminophenyl)-2-(2,4-dimethylphenoxy)propanamide
CID 16781926
(2R)-N-(2-bromophenyl)-2-(2,4-dimethylphenoxy)propanamide
CID 837584
2-(5-methyl-2-propan-2-ylphenoxy)-N-(2-phenylphenyl)propanamide
CID 133162179
[2-(5-benzamido-4-chloro-3-phenylpyrazol-1-yl)-5-[2-[2-(2,4-dimethylphenoxy)propanoylamino]phenyl]-1H-imidazol-4-yl] N,N-dibutylcarbamate
CID 54320957
(2R)-2-(2-methylphenoxy)-N-(2-phenoxyphenyl)propanamide
CID 30392256
(2S)-2-(2,4-dimethylphenoxy)-N-(3-methylphenyl)propanamide
CID 837580
(2R)-2-(2,4-dimethylphenoxy)-N-(3-methylphenyl)propanamide
CID 837579
2-(2,4-dimethylphenoxy)-N-(3,5-dimethylphenyl)propanamide
CID 6916117
N-[(2S)-butan-2-yl]-2-[[(2R)-2-(2,4-dimethylphenoxy)propanoyl]amino]benzamide
CID 9173023

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide?
The IUPAC name of 2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide (CID 22095117) is 2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide.
What is the SMILES notation for 2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide?
The canonical SMILES for 2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide is Cc1ccc(OC(C)C(=O)Nc2ccccc2-c2[nH]c(-c3ccccc3)nc2Oc2ccccc2)c(C)c1.
What is the InChIKey of 2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide?
The InChIKey is OGMYPPZLKKUULL-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H29N3O3/c1-21-18-19-28(22(2)20-21)37-23(3)31(36)33-27-17-11-10-16-26(27)29-32(38-25-14-8-5-9-15-25)35-30(34-29)24-12-6-4-7-13-24/h4-20,23H,1-3H3,(H,33,36)(H,34,35).
What are the key properties of 2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide?
2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide has a molecular weight of 503.60 g/mol, XLogP of 7.56, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenoxy)-N-[2-(4-phenoxy-2-phenyl-1H-imidazol-5-yl)phenyl]propanamide is sourced from PubChem (CID 22095117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).