2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide

C20H24N2O3 — CID 112997388

IUPAC2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide
SMILESCOc1ccccc1C(=O)NCC(=O)Nc1c(C)cccc1C(C)C
InChIInChI=1S/C20H24N2O3/c1-13(2)15-10-7-8-14(3)19(15)22-18(23)12-21-20(24)16-9-5-6-11-17(16)25-4/h5-11,13H,12H2,1-4H3,(H,21,24)(H,22,23)
InChIKeySMBXIDXEHQDGAT-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.50
Rot. Bonds6

About 2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide

2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide (PubChem CID 112997388) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide
PubChem CID112997388
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide
SMILESCOc1ccccc1C(=O)NCC(=O)Nc1c(C)cccc1C(C)C
InChIInChI=1S/C20H24N2O3/c1-13(2)15-10-7-8-14(3)19(15)22-18(23)12-21-20(24)16-9-5-6-11-17(16)25-4/h5-11,13H,12H2,1-4H3,(H,21,24)(H,22,23)
InChIKeySMBXIDXEHQDGAT-UHFFFAOYSA-N
XLogP3.50
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide 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-[[2-(2-methoxyphenoxy)acetyl]amino]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 112997414
2-(3,4-dimethoxyphenyl)-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]acetamide
CID 112997410
2-ethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 4106952
[(2S)-1-(2,6-dimethylanilino)-1-oxopropan-2-yl] 2-[(2-methoxybenzoyl)amino]acetate
CID 8736034
[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl] 2-[(2-iodobenzoyl)amino]acetate
CID 55307446
2-(2-acetylphenoxy)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 112781602
N-[2,6-di(propan-2-yl)phenyl]-2-[[(1R)-1-(2-methoxyphenyl)ethyl]amino]acetamide
CID 7986587
[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl] 2-(2-methoxyphenoxy)acetate
CID 7854161
2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 844817
N-[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]-2-methoxybenzamide
CID 41176984
2-(2-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 109008141
[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl] 2,3,4-trimethoxybenzoate
CID 2337018

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide?
The IUPAC name of 2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide (CID 112997388) is 2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide?
The canonical SMILES for 2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide is COc1ccccc1C(=O)NCC(=O)Nc1c(C)cccc1C(C)C.
What is the InChIKey of 2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide?
The InChIKey is SMBXIDXEHQDGAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-13(2)15-10-7-8-14(3)19(15)22-18(23)12-21-20(24)16-9-5-6-11-17(16)25-4/h5-11,13H,12H2,1-4H3,(H,21,24)(H,22,23).
What are the key properties of 2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide?
2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide has a molecular weight of 340.42 g/mol, XLogP of 3.50, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide is sourced from PubChem (CID 112997388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).