4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide

C15H23N3O3S — CID 94182162

IUPAC4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide
SMILESC[C@@H]1CCCCN1CCNS(=O)(=O)c1ccc(C(N)=O)cc1
InChIInChI=1S/C15H23N3O3S/c1-12-4-2-3-10-18(12)11-9-17-22(20,21)14-7-5-13(6-8-14)15(16)19/h5-8,12,17H,2-4,9-11H2,1H3,(H2,16,19)/t12-/m1/s1
InChIKeyFOBHBUULOIKHDU-GFCCVEGCSA-N
MW325.43 g/mol
LogP0.94
Rot. Bonds6

About 4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide

4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide (PubChem CID 94182162) has the molecular formula C15H23N3O3S and a molecular weight of 325.43 g/mol. Its IUPAC name is 4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide.

Molecular Properties

Compound Name4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide
PubChem CID94182162
Molecular FormulaC15H23N3O3S
Molecular Weight325.43 g/mol
Exact Mass325.15
IUPAC Name4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide
SMILESC[C@@H]1CCCCN1CCNS(=O)(=O)c1ccc(C(N)=O)cc1
InChIInChI=1S/C15H23N3O3S/c1-12-4-2-3-10-18(12)11-9-17-22(20,21)14-7-5-13(6-8-14)15(16)19/h5-8,12,17H,2-4,9-11H2,1H3,(H2,16,19)/t12-/m1/s1
InChIKeyFOBHBUULOIKHDU-GFCCVEGCSA-N
XLogP0.94
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.43
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[(2R)-2-[(2R)-2-methylpiperidin-1-yl]propyl]sulfamoyl]benzamide
CID 124839638
3-[(4-tert-butylphenyl)sulfonylamino]-N-[2-(2-methylpiperidin-1-yl)ethyl]propanamide
CID 55723525
3-[(4-fluorophenyl)sulfonylamino]-N-[3-(2-methylpiperidin-1-yl)propyl]propanamide
CID 51221562
4-butyl-N-[3-(2-methylpiperidin-1-yl)propyl]benzenesulfonamide
CID 3835146
N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-4-methylsulfonylbenzamide
CID 9473048
N-[2-(2-methylpiperidin-1-yl)ethyl]thiophene-2-sulfonamide
CID 47206387
N-[2-[(2S)-2-methylpiperidin-1-yl]ethyl]thiophene-2-sulfonamide
CID 94197160
4-[(4-methylphenyl)sulfamoyl]-N-[3-(2-methylpiperidin-1-yl)propyl]benzamide
CID 84975147
2-methyl-1-[2-[(4-methylphenyl)sulfonylamino]ethyl]-3-[3-(2-methylpiperidin-1-yl)propyl]guanidine
CID 111370825
1-[2-(benzenesulfonamido)ethyl]-2-methyl-3-[3-(2-methylpiperidin-1-yl)propyl]guanidine
CID 111370199
4-amino-N-[3-[(2R)-2-methylpiperidin-1-yl]propyl]benzamide
CID 38989093
5-chloro-N-[2-[(2S)-2-methylpiperidin-1-yl]ethyl]pyrimidine-2-sulfonamide
CID 124853404

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide?
The IUPAC name of 4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide (CID 94182162) is 4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide.
What is the SMILES notation for 4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide?
The canonical SMILES for 4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide is C[C@@H]1CCCCN1CCNS(=O)(=O)c1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide?
The InChIKey is FOBHBUULOIKHDU-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H23N3O3S/c1-12-4-2-3-10-18(12)11-9-17-22(20,21)14-7-5-13(6-8-14)15(16)19/h5-8,12,17H,2-4,9-11H2,1H3,(H2,16,19)/t12-/m1/s1.
What are the key properties of 4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide?
4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide has a molecular weight of 325.43 g/mol, XLogP of 0.94, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide is sourced from PubChem (CID 94182162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).