2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide

C24H23FN2O4 — CID 56566186

IUPAC2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide
SMILESCc1ccc(Oc2ccc(OCC(=O)N(C)C(C(N)=O)c3cccc(F)c3)cc2)cc1
InChIInChI=1S/C24H23FN2O4/c1-16-6-8-20(9-7-16)31-21-12-10-19(11-13-21)30-15-22(28)27(2)23(24(26)29)17-4-3-5-18(25)14-17/h3-14,23H,15H2,1-2H3,(H2,26,29)
InChIKeyMBZWTMNYYOMOEY-UHFFFAOYSA-N
MW422.46 g/mol
LogP3.99
Rot. Bonds8

About 2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide

2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide (PubChem CID 56566186) has the molecular formula C24H23FN2O4 and a molecular weight of 422.46 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide
PubChem CID56566186
Molecular FormulaC24H23FN2O4
Molecular Weight422.46 g/mol
Exact Mass422.16
IUPAC Name2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide
SMILESCc1ccc(Oc2ccc(OCC(=O)N(C)C(C(N)=O)c3cccc(F)c3)cc2)cc1
InChIInChI=1S/C24H23FN2O4/c1-16-6-8-20(9-7-16)31-21-12-10-19(11-13-21)30-15-22(28)27(2)23(24(26)29)17-4-3-5-18(25)14-17/h3-14,23H,15H2,1-2H3,(H2,26,29)
InChIKeyMBZWTMNYYOMOEY-UHFFFAOYSA-N
XLogP3.99
TPSA81.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.46
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]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-fluorophenyl)-2-[methyl-[4-(3-methylbutoxy)phenyl]sulfonylamino]acetamide
CID 86886855
2-(3-fluorophenyl)-3-(4-methylphenoxy)propanoic acid
CID 117243463
2-(3-fluorophenyl)-2-[methyl-[2-(2-methylthieno[2,3-e][1,3]benzothiazol-5-yl)oxyacetyl]amino]acetamide
CID 56569582
N-[3-[[(1S)-2-amino-1-(3-fluorophenyl)-2-oxoethyl]-methylamino]-3-oxopropyl]-2,2-dimethylpropanamide
CID 95348415
2-[methyl-[2-(4-methylphenoxy)acetyl]amino]propanoic acid
CID 62626374
2-(3-fluorophenyl)-3-(4-methylphenoxy)propan-1-ol
CID 117243108
2-(3-fluorophenyl)-2-[methyl-[(4-phenylphenyl)methyl]amino]acetamide
CID 86886828
(2S)-2-[[2-(benzotriazol-1-yl)acetyl]-methylamino]-2-(3-fluorophenyl)acetamide
CID 95330771
2-(3-fluorophenyl)-2-[[4-(hydroxymethyl)phenyl]methyl-methylamino]acetamide
CID 110009403
N-[(3-fluorophenyl)methyl]-N-methyl-2-(4-propan-2-ylphenoxy)acetamide
CID 112778017
N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide
CID 8919009
N-[2-amino-1-(3-fluorophenyl)-2-oxoethyl]-3-chloro-5-methoxy-N-methyl-4-(2-methylpropoxy)benzamide
CID 56566598

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide?
The IUPAC name of 2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide (CID 56566186) is 2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide?
The canonical SMILES for 2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide is Cc1ccc(Oc2ccc(OCC(=O)N(C)C(C(N)=O)c3cccc(F)c3)cc2)cc1.
What is the InChIKey of 2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide?
The InChIKey is MBZWTMNYYOMOEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23FN2O4/c1-16-6-8-20(9-7-16)31-21-12-10-19(11-13-21)30-15-22(28)27(2)23(24(26)29)17-4-3-5-18(25)14-17/h3-14,23H,15H2,1-2H3,(H2,26,29).
What are the key properties of 2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide?
2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide has a molecular weight of 422.46 g/mol, XLogP of 3.99, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-2-[methyl-[2-[4-(4-methylphenoxy)phenoxy]acetyl]amino]acetamide is sourced from PubChem (CID 56566186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).