N-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide

C17H27N3O3S — CID 119993892

IUPACN-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide
SMILESCCCN(C1CCNCC1)S(=O)(=O)c1ccc(C)c(NC(C)=O)c1
InChIInChI=1S/C17H27N3O3S/c1-4-11-20(15-7-9-18-10-8-15)24(22,23)16-6-5-13(2)17(12-16)19-14(3)21/h5-6,12,15,18H,4,7-11H2,1-3H3,(H,19,21)
InChIKeyPRVGJQNFCUXYBP-UHFFFAOYSA-N
MW353.49 g/mol
LogP2.11
Rot. Bonds6

About N-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide

N-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide (PubChem CID 119993892) has the molecular formula C17H27N3O3S and a molecular weight of 353.49 g/mol. Its IUPAC name is N-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide
PubChem CID119993892
Molecular FormulaC17H27N3O3S
Molecular Weight353.49 g/mol
Exact Mass353.18
IUPAC NameN-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide
SMILESCCCN(C1CCNCC1)S(=O)(=O)c1ccc(C)c(NC(C)=O)c1
InChIInChI=1S/C17H27N3O3S/c1-4-11-20(15-7-9-18-10-8-15)24(22,23)16-6-5-13(2)17(12-16)19-14(3)21/h5-6,12,15,18H,4,7-11H2,1-3H3,(H,19,21)
InChIKeyPRVGJQNFCUXYBP-UHFFFAOYSA-N
XLogP2.11
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.49
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide;hydrochloride
CID 119993891
N-[2-fluoro-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide;hydrochloride
CID 119994184
3-acetyl-N-piperidin-4-yl-N-propylbenzenesulfonamide
CID 119994136
methyl 2-methyl-5-[propyl(pyrrolidin-3-yl)sulfamoyl]benzoate;hydrochloride
CID 119976853
3-fluoro-4-(methanesulfonamido)-N-piperidin-4-yl-N-propylbenzenesulfonamide;hydrochloride
CID 119993908
N-[2-methyl-5-(piperidin-4-ylsulfamoyl)phenyl]acetamide;hydrochloride
CID 119960595
N-piperidin-4-yl-N-propylnaphthalene-2-sulfonamide
CID 119993833
4-fluoro-3,5-dimethyl-N-piperidin-4-yl-N-propylbenzenesulfonamide
CID 119993817
4-N-piperidin-4-yl-4-N-propylbenzene-1,4-disulfonamide
CID 175760574
3-chloro-4-methyl-N-propyl-N-pyrrolidin-3-ylbenzenesulfonamide;hydrochloride
CID 119976554
1-acetyl-N-piperidin-4-yl-N-propyl-2,3-dihydroindole-6-sulfonamide
CID 119994113
methyl 3-methyl-4-[piperidin-4-yl(propyl)sulfamoyl]benzoate
CID 119994102

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide (CID 119993892) is N-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide is CCCN(C1CCNCC1)S(=O)(=O)c1ccc(C)c(NC(C)=O)c1.
What is the InChIKey of N-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide?
The InChIKey is PRVGJQNFCUXYBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O3S/c1-4-11-20(15-7-9-18-10-8-15)24(22,23)16-6-5-13(2)17(12-16)19-14(3)21/h5-6,12,15,18H,4,7-11H2,1-3H3,(H,19,21).
What are the key properties of N-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide?
N-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide has a molecular weight of 353.49 g/mol, XLogP of 2.11, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-5-[piperidin-4-yl(propyl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 119993892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).