N-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide

C16H21N3O3 — CID 108503788

IUPACN-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide
SMILESCN(C(=O)C(=O)NC(=O)c1ccccc1N)C1CCCCC1
InChIInChI=1S/C16H21N3O3/c1-19(11-7-3-2-4-8-11)16(22)15(21)18-14(20)12-9-5-6-10-13(12)17/h5-6,9-11H,2-4,7-8,17H2,1H3,(H,18,20,21)
InChIKeyFALJMTUJBVHKKX-UHFFFAOYSA-N
MW303.36 g/mol
LogP1.32
Rot. Bonds2

About N-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide

N-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide (PubChem CID 108503788) has the molecular formula C16H21N3O3 and a molecular weight of 303.36 g/mol. Its IUPAC name is N-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide.

Molecular Properties

Compound NameN-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide
PubChem CID108503788
Molecular FormulaC16H21N3O3
Molecular Weight303.36 g/mol
Exact Mass303.16
IUPAC NameN-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide
SMILESCN(C(=O)C(=O)NC(=O)c1ccccc1N)C1CCCCC1
InChIInChI=1S/C16H21N3O3/c1-19(11-7-3-2-4-8-11)16(22)15(21)18-14(20)12-9-5-6-10-13(12)17/h5-6,9-11H,2-4,7-8,17H2,1H3,(H,18,20,21)
InChIKeyFALJMTUJBVHKKX-UHFFFAOYSA-N
XLogP1.32
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze N-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide 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-amino-N-cyclobutyl-N-methylbenzamide
CID 115747527
2-amino-N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoacetyl]benzamide
CID 108524895
2-amino-N-[3-[cyclohexyl(methyl)amino]propyl]benzamide
CID 60981646
3-amino-N-cyclohexyl-2-hydroxy-N-methylbenzamide
CID 58736495
2-amino-N-[2-(2-methylpiperidin-1-yl)-2-oxoacetyl]benzamide
CID 108523389
2-amino-N-[3-(dimethylamino)cyclohexyl]benzamide;dihydrochloride
CID 119947270
2-(2-aminophenyl)-N-cyclohexyl-N-methylacetamide
CID 16793266
2-bromo-N-cycloheptyl-N-methylbenzamide
CID 43409214
2-(2-aminophenyl)sulfanyl-N-cyclopentyl-N-methylbenzamide
CID 166391273
2-amino-N-(cyclohexylmethyl)benzamide
CID 43215482
2-amino-N-[2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxoacetyl]benzamide
CID 108529491
2-amino-N-methyl-N-(oxan-4-yl)benzamide
CID 43610601

Frequently Asked Questions

What is the IUPAC name of N-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide?
The IUPAC name of N-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide (CID 108503788) is N-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide.
What is the SMILES notation for N-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide?
The canonical SMILES for N-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide is CN(C(=O)C(=O)NC(=O)c1ccccc1N)C1CCCCC1.
What is the InChIKey of N-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide?
The InChIKey is FALJMTUJBVHKKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O3/c1-19(11-7-3-2-4-8-11)16(22)15(21)18-14(20)12-9-5-6-10-13(12)17/h5-6,9-11H,2-4,7-8,17H2,1H3,(H,18,20,21).
What are the key properties of N-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide?
N-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide has a molecular weight of 303.36 g/mol, XLogP of 1.32, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminobenzoyl)-N'-cyclohexyl-N'-methyloxamide is sourced from PubChem (CID 108503788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).