N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide

C20H25N3O3 — CID 54823920

IUPACN-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide
SMILESCNC(=O)c1ccc(NC(=O)CNc2ccccc2OCC(C)C)cc1
InChIInChI=1S/C20H25N3O3/c1-14(2)13-26-18-7-5-4-6-17(18)22-12-19(24)23-16-10-8-15(9-11-16)20(25)21-3/h4-11,14,22H,12-13H2,1-3H3,(H,21,25)(H,23,24)
InChIKeyMKBJFDUYUKLTBH-UHFFFAOYSA-N
MW355.44 g/mol
LogP3.13
Rot. Bonds8

About N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide

N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide (PubChem CID 54823920) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide.

Molecular Properties

Compound NameN-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide
PubChem CID54823920
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC NameN-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide
SMILESCNC(=O)c1ccc(NC(=O)CNc2ccccc2OCC(C)C)cc1
InChIInChI=1S/C20H25N3O3/c1-14(2)13-26-18-7-5-4-6-17(18)22-12-19(24)23-16-10-8-15(9-11-16)20(25)21-3/h4-11,14,22H,12-13H2,1-3H3,(H,21,25)(H,23,24)
InChIKeyMKBJFDUYUKLTBH-UHFFFAOYSA-N
XLogP3.13
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 53.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]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

N-[4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]phenyl]propanamide
CID 54823688
N-methyl-4-[[2-(2-prop-2-enoxyanilino)acetyl]amino]benzamide
CID 54824363
4-[[2-(2-butoxyanilino)acetyl]amino]-N-methylbenzamide
CID 54828140
N-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide
CID 28642656
4-[[2-[2-(2-methylpropoxy)anilino]-2-oxoethyl]amino]-N-(1-phenylethyl)benzamide
CID 54846111
N-ethyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]-N-phenylbenzamide
CID 54823853
2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide
CID 54824046
2-(2-methoxyanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54817214
N-[3-(2-methoxyethoxy)phenyl]-2-[2-(2-methylpropoxy)anilino]acetamide
CID 54823718
4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide
CID 54817374
2-(3,4-dimethylanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54811574
2-(2,3-dimethylanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54815991

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide?
The IUPAC name of N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide (CID 54823920) is N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide.
What is the SMILES notation for N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide?
The canonical SMILES for N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide is CNC(=O)c1ccc(NC(=O)CNc2ccccc2OCC(C)C)cc1.
What is the InChIKey of N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide?
The InChIKey is MKBJFDUYUKLTBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-14(2)13-26-18-7-5-4-6-17(18)22-12-19(24)23-16-10-8-15(9-11-16)20(25)21-3/h4-11,14,22H,12-13H2,1-3H3,(H,21,25)(H,23,24).
What are the key properties of N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide?
N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide has a molecular weight of 355.44 g/mol, XLogP of 3.13, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide is sourced from PubChem (CID 54823920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).