N-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide

C13H19N3O3S — CID 104645741

IUPACN-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCCNC2)cc1
InChIInChI=1S/C13H19N3O3S/c1-10(17)15-11-4-6-13(7-5-11)20(18,19)16-12-3-2-8-14-9-12/h4-7,12,14,16H,2-3,8-9H2,1H3,(H,15,17)/t12-/m1/s1
InChIKeyYPHLCOHUEDYRHH-GFCCVEGCSA-N
MW297.38 g/mol
LogP0.68
Rot. Bonds4

About N-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide

N-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide (PubChem CID 104645741) has the molecular formula C13H19N3O3S and a molecular weight of 297.38 g/mol. Its IUPAC name is N-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide
PubChem CID104645741
Molecular FormulaC13H19N3O3S
Molecular Weight297.38 g/mol
Exact Mass297.11
IUPAC NameN-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCCNC2)cc1
InChIInChI=1S/C13H19N3O3S/c1-10(17)15-11-4-6-13(7-5-11)20(18,19)16-12-3-2-8-14-9-12/h4-7,12,14,16H,2-3,8-9H2,1H3,(H,15,17)/t12-/m1/s1
InChIKeyYPHLCOHUEDYRHH-GFCCVEGCSA-N
XLogP0.68
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-dimethyl-4-(piperidin-3-ylsulfamoyl)benzamide;hydrochloride
CID 120707147
4-chloro-N-piperidin-3-ylbenzenesulfonamide;hydrochloride
CID 119964099
4-methoxy-N-piperidin-3-ylbenzenesulfonamide;hydrochloride
CID 119964408
4-cyano-N-[(3R)-piperidin-3-yl]benzenesulfonamide
CID 104645700
4-(2-methoxyethoxy)-N-piperidin-3-ylbenzenesulfonamide
CID 63321022
4-cyano-N-[(3R)-piperidin-3-yl]benzenesulfonamide;hydrochloride
CID 120723595
4-cyclohexyl-N-[(3S)-piperidin-3-yl]benzenesulfonamide
CID 120716650
N-piperidin-3-yl-4-(trifluoromethyl)benzenesulfonamide
CID 63321069
N-[4-[(4-bromocyclohexyl)sulfamoyl]phenyl]acetamide
CID 114295839
3-acetyl-N-piperidin-3-ylbenzenesulfonamide;hydrochloride
CID 119964549
1-[4-(piperidin-3-ylsulfamoyl)phenyl]-3-(pyridin-3-ylmethyl)urea
CID 140925924
1-acetyl-N-piperidin-3-yl-3,4-dihydro-2H-quinoline-7-sulfonamide
CID 119964163

Frequently Asked Questions

What is the IUPAC name of N-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide (CID 104645741) is N-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCCNC2)cc1.
What is the InChIKey of N-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide?
The InChIKey is YPHLCOHUEDYRHH-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H19N3O3S/c1-10(17)15-11-4-6-13(7-5-11)20(18,19)16-12-3-2-8-14-9-12/h4-7,12,14,16H,2-3,8-9H2,1H3,(H,15,17)/t12-/m1/s1.
What are the key properties of N-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide?
N-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide has a molecular weight of 297.38 g/mol, XLogP of 0.68, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 104645741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).