N-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide

C20H23N3O4S — CID 3276062

IUPACN-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide
SMILESCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1
InChIInChI=1S/C20H23N3O4S/c1-21-20(25)17-10-3-4-11-18(17)22-19(24)15-8-7-9-16(14-15)28(26,27)23-12-5-2-6-13-23/h3-4,7-11,14H,2,5-6,12-13H2,1H3,(H,21,25)(H,22,24)
InChIKeyCJRYNAZXWMNLMX-UHFFFAOYSA-N
MW401.49 g/mol
LogP2.47
Rot. Bonds5

About N-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide

N-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide (PubChem CID 3276062) has the molecular formula C20H23N3O4S and a molecular weight of 401.49 g/mol. Its IUPAC name is N-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide.

Molecular Properties

Compound NameN-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide
PubChem CID3276062
Molecular FormulaC20H23N3O4S
Molecular Weight401.49 g/mol
Exact Mass401.14
IUPAC NameN-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide
SMILESCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1
InChIInChI=1S/C20H23N3O4S/c1-21-20(25)17-10-3-4-11-18(17)22-19(24)15-8-7-9-16(14-15)28(26,27)23-12-5-2-6-13-23/h3-4,7-11,14H,2,5-6,12-13H2,1H3,(H,21,25)(H,22,24)
InChIKeyCJRYNAZXWMNLMX-UHFFFAOYSA-N
XLogP2.47
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.49
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N,N-dimethyl-4-(pyrrolidin-1-yl)benzene-1-sulfonamide
CID 2440433
N-Benzyl-N-butyl-4-(N-phenylsulfamoyl)benzamide
CID 137796294
N-(4-methylphenyl)-3-(piperidin-1-ylcarbonyl)benzenesulfonamide
CID 2361079
2-(benzenesulfonamido)-N-(thiolan-3-yl)benzamide
CID 2805665
N-(4-{[(1-butyrylpiperidin-4-yl)amino]sulfonyl}-1-naphthyl)-2-methylbenzamide
CID 10391001
N,N-Bis[3-(dimethylamino)propyl]-1-[[4-[(2,2-diphenylethyl)amino]-3-(4-morpholinylcarbonyl)phenyl]sulfonyl]-4-piperidinecarboxamide
CID 11320189
N-(2-Benzoyl-phenyl)-4-[3-(3-piperidin-1-yl-propyl)-ureido]-benzenesulfonamide
CID 24895452
2-(benzylamino)-N-butyl-4-chloro-5-sulfamoylbenzamide
CID 126507891
2-(benzylamino)-4-bromo-N-butyl-5-sulfamoylbenzamide
CID 126508113
N-benzyl-2-(benzylamino)-4-chloro-5-sulfamoylbenzamide
CID 126508254
1-Benzyl-3-isopropyl-1,2,3,4-tetrahydro-2lambda~6~,1,3-benzothiadiazine-2,2,4-trione
CID 2825491
N,N-diethyl-6-oxo-5,6-dihydrophenanthridine-2-sulfonamide
CID 6324455

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide?
The IUPAC name of N-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide (CID 3276062) is N-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide.
What is the SMILES notation for N-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide?
The canonical SMILES for N-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide is CNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1.
What is the InChIKey of N-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide?
The InChIKey is CJRYNAZXWMNLMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O4S/c1-21-20(25)17-10-3-4-11-18(17)22-19(24)15-8-7-9-16(14-15)28(26,27)23-12-5-2-6-13-23/h3-4,7-11,14H,2,5-6,12-13H2,1H3,(H,21,25)(H,22,24).
What are the key properties of N-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide?
N-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide has a molecular weight of 401.49 g/mol, XLogP of 2.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzamide is sourced from PubChem (CID 3276062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).